化学式

CAS号

IUPAC Name

叔-丁基3-[[(12S,15S,18S)-7-溴-4-氯-15-[3,3-二氟-4-[(2-甲基-2-基)oxycarbonylamino]丁基]-13-甲基-18-[3-[(2-甲基-2-基)oxycarbonylamino]丙基]-11,14,17-三氧代-2-硫杂-4,10,13,16,19-pentazatricyclo[19.4.0.03,8]pentacosa-1(25),3(8),6,21,23-pentaen-12-基]甲基]吲哚-1-甲酸基酯 tert-butyl 3-[[(12S,15S,18S)-7-bromo-4-chloro-15-[3,3-difluoro-4-[(2-methylpropan-2-yl)oxycarbonylamino]butyl]-13-methyl-18-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propyl]-11,14,17-trioxo-2-thia-4,10,13,16,19-pentazatricyclo[19.4.0.03,8]pentacosa-1(25),3(8),6,21,23-pentaen-12-yl]methyl]indole-1-carboxylate

InChI

InChI=1S/C51H68BrClF2N8O9S/c1-48(2,3)70-45(67)56-24-15-18-36-41(64)60-37(21-23-51(54,55)30-59-46(68)71-49(4,5)6)43(66)61(10)39(26-32-29-62(47(69)72-50(7,8)9)38-19-13-12-17-33(32)38)42(65)58-28-34-35(52)22-25-63(53)44(34)73-40-20-14-11-16-31(40)27-57-36/h11-14,16-17,19-20,22,29,36-37,39,57H,15,18,21,23-28,30H2,1-10H3,(H,56,67)(H,58,65)(H,59,68)(H,60,64)/t36-,37-,39-/m0/s1

InChI Key

BUDYWEAQTURRNM-UZGNFBRWSA-N

Canonical SMILES

CC(C)(C)OC(=O)NCCCC1C(=O)NC(C(=O)N(C(C(=O)NCC2=C(N(CC=C2Br)Cl)SC3=CC=CC=C3CN1)CC4=CN(C5=CC=CC=C54)C(=O)OC(C)(C)C)C)CCC(CNC(=O)OC(C)(C)C)(F)F

别名

• SCHEMBL21488693