化学式

CAS号

IUPAC Name

2-[(2S)-1-[(2S,9S)-10-[(2S)-2-(5-苄基-1,3-噁唑-2-基)吡咯烷-1-基]-2-[[(3S)-3-[氯(甲基)氨基]丁-1-烯-2-基]氨基]-9-[[(2S)-2-(甲基氨基)丙酰基]氨基]-10-oxodecanoyl]吡咯烷-2-基]-N-苯基-1,3-噁唑-5-羧酰胺 2-[(2S)-1-[(2S,9S)-10-[(2S)-2-(5-benzyl-1,3-oxazol-2-yl)pyrrolidin-1-yl]-2-[[(3S)-3-[chloro(methyl)amino]but-1-en-2-yl]amino]-9-[[(2S)-2-(methylamino)propanoyl]amino]-10-oxodecanoyl]pyrrolidin-2-yl]-N-phenyl-1,3-oxazole-5-carboxamide

InChI

InChI=1S/C47H62ClN9O6/c1-31(33(3)55(5)48)52-37(46(60)57-27-17-25-40(57)45-51-30-41(63-45)43(59)53-35-20-12-9-13-21-35)22-14-6-7-15-23-38(54-42(58)32(2)49-4)47(61)56-26-16-24-39(56)44-50-29-36(62-44)28-34-18-10-8-11-19-34/h8-13,18-21,29-30,32-33,37-40,49,52H,1,6-7,14-17,22-28H2,2-5H3,(H,53,59)(H,54,58)/t32-,33-,37-,38-,39-,40-/m0/s1

InChI Key

SXXLUDUSZUHKPS-WGUCSKAXSA-N

Canonical SMILES

CC(C(=O)NC(CCCCCCC(C(=O)N1CCCC1C2=NC=C(O2)C(=O)NC3=CC=CC=C3)NC(=C)C(C)N(C)Cl)C(=O)N4CCCC4C5=NC=C(O5)CC6=CC=CC=C6)NC

别名

• SCHEMBL16137973