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克罗散泰CAS号 : 57808-65-8 Compound CID : 42574分子式: C22H14Cl2I2N2O2 分子量: 663.07IUPAC Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-2-hydroxy-3,5-diiodobenzamideSMILES: CC1=CC(=C(C=C1NC(=O)C2=C(C(=CC(=C2)I)I)O)Cl)C(C#N)C3=CC=C(C=C3)ClInChIKey: JMPFSEBWVLAJKM-UHFFFAOYSA-NInChI: InChI=1S/C22H14Cl2I2N2O2/c1-11-6-15(17(10-27)12-2-4-13(23)5-3-12)18(24)9-20(11)28-22(30)16-7-14(25)8-19(26)21(16)29/h2-9,17,29H,1H3,(H,28,30)
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CAY10498,A 3腺苷受体拮抗剂CAS号 : 863202-33-9 Compound CID : 53394567分子式: C18H20N6 分子量: 320.4IUPAC Name: 6-N-(2-bicyclo[2.2.1]heptanyl)-2-N-phenyl-7H-purine-2,6-diamineSMILES: C1CC2CC1CC2NC3=NC(=NC4=C3NC=N4)NC5=CC=CC=C5InChIKey: SLLSODGWHDUMRG-UHFFFAOYSA-NInChI: InChI=1S/C18H20N6/c1-2-4-13(5-3-1)21-18-23-16-15(19-10-20-16)17(24-18)22-14-9-11-6-7-12(14)8-11/h1-5,10-12,14H,6-9H2,(H3,19,20,21,22,23,24)
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N6-（2-苯乙基）腺苷CAS号 : 20125-39-7 Compound CID : 9929340分子式: C18H21N5O4 分子量: 371.39IUPAC Name: (2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(2-phenylethylamino)purin-9-yl]oxolane-3,4-diolSMILES: C1=CC=C(C=C1)CCNC2=C3C(=NC=N2)N(C=N3)C4C(C(C(O4)CO)O)OInChIKey: LGZYEDZSPHLISU-SCFUHWHPSA-NInChI: InChI=1S/C18H21N5O4/c24-8-12-14(25)15(26)18(27-12)23-10-22-13-16(20-9-21-17(13)23)19-7-6-11-4-2-1-3-5-11/h1-5,9-10,12,14-15,18,24-26H,6-8H2,(H,19,20,21)/t12-,14-,15-,18-/m1/s1
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伊曲茶碱CAS号 : 155270-99-8(DMSO)分子式: C20H24N4O4 分子量: 384.43SMILES: CCN1C(=O)N(CC)C2=C([N](C)C(=N2)\C=C\C3=CC=C(OC)C(=C3)OC)C1=O
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克罗散泰CAS号 : 57808-65-8 Compound CID : 42574分子式: C22H14Cl2I2N2O2 分子量: 663.07IUPAC Name: N-[5-chloro-4-[(4-chlorophenyl)-cyanomethyl]-2-methylphenyl]-2-hydroxy-3,5-diiodobenzamideSMILES: CC1=CC(=C(C=C1NC(=O)C2=C(C(=CC(=C2)I)I)O)Cl)C(C#N)C3=CC=C(C=C3)ClInChIKey: JMPFSEBWVLAJKM-UHFFFAOYSA-NInChI: InChI=1S/C22H14Cl2I2N2O2/c1-11-6-15(17(10-27)12-2-4-13(23)5-3-12)18(24)9-20(11)28-22(30)16-7-14(25)8-19(26)21(16)29/h2-9,17,29H,1H3,(H,28,30)
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5'-乙基羧酰胺基腺苷CAS号 : 35920-39-9 Compound CID : 448222分子式: C12H16N6O4 分子量: 308.3IUPAC Name: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxyoxolane-2-carboxamideSMILES: CCNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OInChIKey: JADDQZYHOWSFJD-FLNNQWSLSA-NInChI: InChI=1S/C12H16N6O4/c1-2-14-11(21)8-6(19)7(20)12(22-8)18-4-17-5-9(13)15-3-16-10(5)18/h3-4,6-8,12,19-20H,2H2,1H3,(H,14,21)(H2,13,15,16)/t6-,7+,8-,12+/m0/s1
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4-methoxy-N-(3-phenyl-1,2,4-thiadiazol-5-yl)benzamideCAS号 : 331472-31-2 Compound CID : 667741分子式: C16H13N3O2S 分子量: 311.4IUPAC Name: 4-methoxy-N-(3-phenyl-1,2,4-thiadiazol-5-yl)benzamideSMILES: COC1=CC=C(C=C1)C(=O)NC2=NC(=NS2)C3=CC=CC=C3InChIKey: RGVXOHBJCGPTQH-UHFFFAOYSA-NInChI: InChI=1S/C16H13N3O2S/c1-21-13-9-7-12(8-10-13)15(20)18-16-17-14(19-22-16)11-5-3-2-4-6-11/h2-10H,1H3,(H,17,18,19,20)
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5'-N-methylcarboxamidoadenosineCAS号 : 35788-27-3 Compound CID : 98567分子式: C11H14N6O4 分子量: 294.27IUPAC Name: (2S,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-N-methyloxolane-2-carboxamideSMILES: CNC(=O)C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)OInChIKey: PLYRYAHDNXANEG-QMWPFBOUSA-NInChI: InChI=1S/C11H14N6O4/c1-13-10(20)7-5(18)6(19)11(21-7)17-3-16-4-8(12)14-2-15-9(4)17/h2-3,5-7,11,18-19H,1H3,(H,13,20)(H2,12,14,15)/t5-,6+,7-,11+/m0/s1
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2-phenyl-2,5-dihydro-4H-pyrazolo[3,4-c]quinolin-4-oneCAS号 : 109740-09-2 Compound CID : 4962866分子式: C16H11N3O 分子量: 261.279IUPAC Name: 2-phenyl-5H-pyrazolo[3,4-c]quinolin-4-oneSMILES: C1=CC=C(C=C1)N2C=C3C4=CC=CC=C4NC(=O)C3=N2InChIKey: ISMLHIIGSRUCOQ-UHFFFAOYSA-NInChI: InChI=1S/C16H11N3O/c20-16-15-13(12-8-4-5-9-14(12)17-16)10-19(18-15)11-6-2-1-3-7-11/h1-10H,(H,17,20)
