化学式

CAS号

IUPAC Name

(2S,4R)-4-(7-氯-4-甲氧基-1-基)氧基-1-[(2S)-2-[氯-[4-(4-甲基苯基)-1,3-噻唑-2-基]氨基]-3,3-dimethylbutanoyl]-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-乙烯基环丙基]吡咯烷-2-羧酰胺 (2S,4R)-4-(7-chloro-4-methoxyisoquinolin-1-yl)oxy-1-[(2S)-2-[chloro-[4-(4-methylphenyl)-1,3-thiazol-2-yl]amino]-3,3-dimethylbutanoyl]-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]pyrrolidine-2-carboxamide

InChI

InChI=1S/C40H44Cl2N6O7S2/c1-7-24-18-40(24,37(51)46-57(52,53)27-13-14-27)45-34(49)31-17-26(55-35-29-16-25(41)12-15-28(29)32(54-6)19-43-35)20-47(31)36(50)33(39(3,4)5)48(42)38-44-30(21-56-38)23-10-8-22(2)9-11-23/h7-12,15-16,19,21,24,26-27,31,33H,1,13-14,17-18,20H2,2-6H3,(H,45,49)(H,46,51)/t24-,26-,31+,33-,40-/m1/s1

InChI Key

GZWGYIJXSMXDOA-MRGLZQARSA-N

Canonical SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)N(C(C(=O)N3CC(CC3C(=O)NC4(CC4C=C)C(=O)NS(=O)(=O)C5CC5)OC6=NC=C(C7=C6C=C(C=C7)Cl)OC)C(C)(C)C)Cl

别名

• SCHEMBL17188773