化学式

CAS号

IUPAC Name

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-羧酸 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-carboxylic acid

InChI

InChI=1S/C47H60BrClF2N8O9S/c1-45(2,3)67-42(63)52-21-12-15-33-38(60)56-34(18-20-47(50,51)27-55-43(64)68-46(4,5)6)40(62)57(7)36(23-29-26-58(44(65)66)35-16-10-9-14-30(29)35)39(61)54-25-31-32(48)19-22-59(49)41(31)69-37-17-11-8-13-28(37)24-53-33/h8-11,13-14,16-17,19,26,33-34,36,53H,12,15,18,20-25,27H2,1-7H3,(H,52,63)(H,54,61)(H,55,64)(H,56,60)(H,65,66)/t33-,34-,36-/m0/s1

InChI Key

GCROOWHHKGPRPY-IUKTVIPNSA-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)O)C)CCC(CNC(=O)OC(C)(C)C)(F)F

别名

• SCHEMBL21488905