化学式

CAS号

IUPAC Name

1-氯-N-[4-[[(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]-4-氧代丁基]-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-[4-[[(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]-4-oxobutyl]-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/C60H74ClF3N10O8/c1-35-30-72(45(29-67-35)32-71-22-25-82-33-36(71)2)38(4)55(76)60(34-74(61)50-27-40(13-18-47(50)60)26-39-11-15-43(62)16-12-39)59(80)66-21-7-10-51(75)68-44-17-14-42-31-73(54(46(42)28-44)57(78)70-53-48(63)8-6-9-49(53)64)58(79)52(41-19-23-81-24-20-41)69-56(77)37(3)65-5/h6,8-9,11-18,27-28,35-38,41,45,52,54,65,67H,7,10,19-26,29-34H2,1-5H3,(H,66,80)(H,68,75)(H,69,77)(H,70,78)/t35-,36-,37+,38?,45-,52+,54+,60?/m1/s1

InChI Key

QQMLDFHLAFDRAA-NMSJJPRJSA-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)NCCCC(=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

• SCHEMBL19596229