化学式

CAS号

IUPAC Name

1-氯-N-[3-[[(3S)-3-[(2,6-二氟苯基)氨基甲酰]-2-[(2S)-2-[[(2S)-2-(甲基氨基)丙酰基]氨基]-2-(四氢吡喃-4-基)乙酰基]-1,3-二氢异吲哚-5-基]氨基]-3-氧代丙基]-6-[(4-氟苯基)甲基]-3-[2-[(2R,5R)-5-甲基-2-[[(3R)-3-甲基吗啉-4-基]甲基]哌嗪-1-基]丙酰基]-2H-吲哚-3-羧酰胺 1-chloro-N-[3-[[(3S)-3-[(2,6-difluorophenyl)carbamoyl]-2-[(2S)-2-[[(2S)-2-(methylamino)propanoyl]amino]-2-(oxan-4-yl)acetyl]-1,3-dihydroisoindol-5-yl]amino]-3-oxopropyl]-6-[(4-fluorophenyl)methyl]-3-[2-[(2R,5R)-5-methyl-2-[[(3R)-3-methylmorpholin-4-yl]methyl]piperazin-1-yl]propanoyl]-2H-indole-3-carboxamide

InChI

InChI=1S/C59H72ClF3N10O8/c1-34-29-71(44(28-66-34)31-70-21-24-81-32-35(70)2)37(4)54(75)59(33-73(60)49-26-39(11-16-46(49)59)25-38-9-13-42(61)14-10-38)58(79)65-20-17-50(74)67-43-15-12-41-30-72(53(45(41)27-43)56(77)69-52-47(62)7-6-8-48(52)63)57(78)51(40-18-22-80-23-19-40)68-55(76)36(3)64-5/h6-16,26-27,34-37,40,44,51,53,64,66H,17-25,28-33H2,1-5H3,(H,65,79)(H,67,74)(H,68,76)(H,69,77)/t34-,35-,36+,37?,44-,51+,53+,59?/m1/s1

InChI Key

ZTWBOFMMFWZJQA-ZVFFCHMQSA-N

Canonical SMILES

CC1CN(C(CN1)CN2CCOCC2C)C(C)C(=O)C3(CN(C4=C3C=CC(=C4)CC5=CC=C(C=C5)F)Cl)C(=O)NCCC(=O)NC6=CC7=C(CN(C7C(=O)NC8=C(C=CC=C8F)F)C(=O)C(C9CCOCC9)NC(=O)C(C)NC)C=C6

别名

• SCHEMBL19584856