小分子和化合物库
选项
-
缬沙坦甲酯CAS号: 137863-17-3分子式: C25H31N5O3 分子量: 449.56IUPAC Name: methyl (2S)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoateSMILES: CCCCC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)C(C(C)C)C(=O)OCInChIKey: UJTNRXYTECQKFO-QHCPKHFHSA-NInChI: 1S/C25H31N5O3/c1-5-6-11-22(31)30(23(17(2)3)25(32)33-4)16-18-12-14-19(15-13-18)20-9-7-8-10-21(20)24-26-28-29-27-24/h7-10,12-15,17,23H,5-6,11,16H2,1-4H3,(H,26,27,28,29)/t23-/m0/s1
-
64 N-(5-氟-4-碘-2-甲基苯基)乙酰胺CAS号: 1440965-36-5分子式: C9H9FINO 分子量: 293.08IUPAC Name: N-(5-fluoro-4-iodo-2-methylphenyl)acetamideSMILES: CC1=CC(=C(C=C1NC(=O)C)F)IInChIKey: IVCNUUVUKIQUDM-UHFFFAOYSA-NInChI: 1S/C9H9FINO/c1-5-3-8(11)7(10)4-9(5)12-6(2)13/h3-4H,1-2H3,(H,12,13)
-
-
-
正十二烷硼酸(含不等量酸酐)CAS号: 3088-79-7分子式: C12H27BO2 分子量: 214.16IUPAC Name: dodecylboronic acidSMILES: B(CCCCCCCCCCCC)(O)OInChIKey: UMJURJHHLVYBFY-UHFFFAOYSA-NInChI: 1S/C12H27BO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h14-15H,2-12H2,1H3
-
4-(4-氟苄基氨基)-1-甲基哌啶CAS号: 359878-47-0分子式: C13H19FN2 分子量: 222.3IUPAC Name: N-[(4-fluorophenyl)methyl]-1-methylpiperidin-4-amineSMILES: CN1CCC(CC1)NCC2=CC=C(C=C2)FInChIKey: PLYWEOOWONUOBN-UHFFFAOYSA-NInChI: 1S/C13H19FN2/c1-16-8-6-13(7-9-16)15-10-11-2-4-12(14)5-3-11/h2-5,13,15H,6-10H2,1H3
-
N-(4-氯-2,5-二甲氧苯基)-3-羟基-2-萘酰胺CAS号: 4273-92-1分子式: C19H16ClNO4 分子量: 357.79IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamideSMILES: COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)OC)ClInChIKey: QIHKTBRNOLQDGQ-UHFFFAOYSA-NInChI: 1S/C19H16ClNO4/c1-24-17-10-15(18(25-2)9-14(17)20)21-19(23)13-7-11-5-3-4-6-12(11)8-16(13)22/h3-10,22H,1-2H3,(H,21,23)
-
2-氯-N-(2-(2,6-二氧代哌啶-3-基)-1,3-二氧代异吲哚啉-4-基)乙酰胺CAS号: 444287-84-7分子式: C15H12ClN3O5 分子量: 349.73IUPAC Name: 2-chloro-N-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]acetamideSMILES: C1CC(=O)NC(=O)C1N2C(=O)C3=C(C2=O)C(=CC=C3)NC(=O)CClInChIKey: SVSMQAPPCVNXQW-UHFFFAOYSA-NInChI: 1S/C15H12ClN3O5/c16-6-11(21)17-8-3-1-2-7-12(8)15(24)19(14(7)23)9-4-5-10(20)18-13(9)22/h1-3,9H,4-6H2,(H,17,21)(H,18,20,22)
-
4-硝基苯甲酰甲醛一水合物CAS号: 4996-22-9分子式: C8H7NO5 分子量: 197.15IUPAC Name: 2,2-dihydroxy-1-(4-nitrophenyl)ethanoneSMILES: C1=CC(=CC=C1C(=O)C(O)O)[N+](=O)[O-]InChIKey: DUGSDYIJZMWGNA-UHFFFAOYSA-NInChI: 1S/C8H7NO5/c10-7(8(11)12)5-1-3-6(4-2-5)9(13)14/h1-4,8,11-12H
-
N-(7-氯喹啉-4-基)乙烷-1,2-二胺CAS号: 5407-57-8分子式: C11H12ClN3 分子量: 221.69IUPAC Name: N'-(7-chloroquinolin-4-yl)ethane-1,2-diamineSMILES: C1=CC2=C(C=CN=C2C=C1Cl)NCCNInChIKey: XBDASFGJHWAFFE-UHFFFAOYSA-NInChI: 1S/C11H12ClN3/c12-8-1-2-9-10(15-6-4-13)3-5-14-11(9)7-8/h1-3,5,7H,4,6,13H2,(H,14,15)
-
3-硝基-α-苯基甲烷磺酰氯CAS号: 58032-84-1分子式: C7H6ClNO4S 分子量: 235.64IUPAC Name: (3-nitrophenyl)methanesulfonyl chlorideSMILES: C1=CC(=CC(=C1)[N+](=O)[O-])CS(=O)(=O)ClInChIKey: IUYFKLDRPZLAQQ-UHFFFAOYSA-NInChI: 1S/C7H6ClNO4S/c8-14(12,13)5-6-2-1-3-7(4-6)9(10)11/h1-4H,5H2
-
N-生物素基-1,6-己二胺CAS号: 65953-56-2分子式: C16H30N4O2S 分子量: 342.5IUPAC Name: 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]-N-(6-aminohexyl)pentanamideSMILES: C1C2C(C(S1)CCCCC(=O)NCCCCCCN)NC(=O)N2InChIKey: QWVNTBHBRBLRRJ-YDHLFZDLSA-NInChI: 1S/C16H30N4O2S/c17-9-5-1-2-6-10-18-14(21)8-4-3-7-13-15-12(11-23-13)19-16(22)20-15/h12-13,15H,1-11,17H2,(H,18,21)(H2,19,20,22)/t12-,13-,15-/m0/s1
首页
400-620-6333











