小分子和化合物库

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显示第112个,产品总数48

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  1. 尼群地平
    CAS号 : 39562-70-4        Compound CID : 4507
    分子式: C18H20N2O6        分子量: 360.36
    IUPAC Name: 5-O-ethyl 3-O-methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
    SMILES: CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C
    InChIKey: PVHUJELLJLJGLN-UHFFFAOYSA-N
    InChI: InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3
  2. 氯唑沙宗
    CAS号 : 95-25-0        Compound CID : 2733
    分子式: C7H4ClNO2        分子量: 169.57
    IUPAC Name: 5-chloro-3H-1,3-benzoxazol-2-one
    SMILES: C1=CC2=C(C=C1Cl)NC(=O)O2
    InChIKey: TZFWDZFKRBELIQ-UHFFFAOYSA-N
    InChI: InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)
  3. Methyl triphenylacetate
    CAS号 : 5467-21-0        Compound CID : 231627
    分子式: C21H18O2        分子量: 302.4
    IUPAC Name: methyl 2,2,2-triphenylacetate
    SMILES: COC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
    InChIKey: ZPGOQUZHRVSLML-UHFFFAOYSA-N
    InChI: InChI=1S/C21H18O2/c1-23-20(22)21(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16H,1H3
  4. NS309,钙依赖性钾离子通道 SK/IK 的激活剂
    CAS号 : 18711-16-5        Compound CID : 135502903
    分子式: C8H4Cl2N2O2        分子量: 231.04
    IUPAC Name: 6,7-dichloro-3-nitroso-1H-indol-2-ol
    SMILES: C1=CC(=C(C2=C1C(=C(N2)O)N=O)Cl)Cl
    InChIKey: ROBYKNONIPZMTK-UHFFFAOYSA-N
    InChI: InChI=1S/C8H4Cl2N2O2/c9-4-2-1-3-6(5(4)10)11-8(13)7(3)12-14/h1-2,11,13H
  5. SKA-31,K Ca 3.1和K Ca 2通道激活剂
    CAS号 : 40172-65-4        Compound CID : 94880
    分子式: C11H8N2S        分子量: 200.26
    IUPAC Name: benzo[e][1,3]benzothiazol-2-amine
    SMILES: C1=CC=C2C(=C1)C=CC3=C2N=C(S3)N
    InChIKey: FECQXVPRUCCUIL-UHFFFAOYSA-N
    InChI: InChI=1S/C11H8N2S/c12-11-13-10-8-4-2-1-3-7(8)5-6-9(10)14-11/h1-6H,(H2,12,13)
  6. 5-(4-苯氧基丁氧基)补骨脂素(PAP-1)
    CAS号 : 870653-45-5        Compound CID : 11302540
    分子式: C21H18O5        分子量: 350.36
    IUPAC Name: 4-(4-phenoxybutoxy)furo[3,2-g]chromen-7-one
    SMILES: C1=CC=C(C=C1)OCCCCOC2=C3C=CC(=O)OC3=CC4=C2C=CO4
    InChIKey: KINMYBBFQRSVLL-UHFFFAOYSA-N
    InChI: InChI=1S/C21H18O5/c22-20-9-8-16-19(26-20)14-18-17(10-13-24-18)21(16)25-12-5-4-11-23-15-6-2-1-3-7-15/h1-3,6-10,13-14H,4-5,11-12H2
  7. Senicapoc,通道阻断剂
    CAS号 : 289656-45-7        Compound CID : 216327
    分子式: C20H15F2NO        分子量: 323.35
    IUPAC Name: 2,2-bis(4-fluorophenyl)-2-phenylacetamide
    SMILES: C1=CC=C(C=C1)C(C2=CC=C(C=C2)F)(C3=CC=C(C=C3)F)C(=O)N
    InChIKey: SCTZUZTYRMOMKT-UHFFFAOYSA-N
    InChI: InChI=1S/C20H15F2NO/c21-17-10-6-15(7-11-17)20(19(23)24,14-4-2-1-3-5-14)16-8-12-18(22)13-9-16/h1-13H,(H2,23,24)
  8. TRAM-34,K Ca 3.1通道阻滞剂
    CAS号 : 289905-88-0        Compound CID : 656734
    分子式: C22H17ClN2        分子量: 344.84
    IUPAC Name: 1-[(2-chlorophenyl)-diphenylmethyl]pyrazole
    SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)N4C=CC=N4
    InChIKey: KBFUQFVFYYBHBT-UHFFFAOYSA-N
    InChI: InChI=1S/C22H17ClN2/c23-21-15-8-7-14-20(21)22(25-17-9-16-24-25,18-10-3-1-4-11-18)19-12-5-2-6-13-19/h1-17H
  9. 氯唑沙宗
    CAS号 : 95-25-0        Compound CID : 2733
    分子式: C7H4ClNO2        分子量: 169.57
    IUPAC Name: 5-chloro-3H-1,3-benzoxazol-2-one
    SMILES: C1=CC2=C(C=C1Cl)NC(=O)O2
    InChIKey: TZFWDZFKRBELIQ-UHFFFAOYSA-N
    InChI: InChI=1S/C7H4ClNO2/c8-4-1-2-6-5(3-4)9-7(10)11-6/h1-3H,(H,9,10)
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