化学式

CAS号

IUPAC Name

4-氨基-3-[[氨基-[1-[4-氨基-2-苯胺基-6-(二氟甲氧基)-5-苯基-3-(三氟甲氧基)苯基]-1-苯胺基-2-甲氧基-2-氧代乙基]氨基]-[叠氮基(氯)氨基]-氟甲基]-2-[苯胺基-[甲氧基(苯基)甲基]氨基]-6-(苄基氨基)-5-氰基苯甲酸 4-amino-3-[[amino-[1-[4-amino-2-anilino-6-(difluoromethoxy)-5-phenyl-3-(trifluoromethoxy)phenyl]-1-anilino-2-methoxy-2-oxoethyl]amino]-[azido(chloro)amino]-fluoromethyl]-2-[anilino-[methoxy(phenyl)methyl]amino]-6-(benzylamino)-5-cyanobenzoic acid

InChI

InChI=1S/C59H51ClF6N14O7/c1-84-53(37-25-13-5-14-26-37)78(75-40-31-19-8-20-32-40)50-43(54(81)82)48(72-34-35-21-9-3-10-22-35)41(33-67)46(68)44(50)58(63,80(60)77-76-70)79(71)57(55(83)85-2,74-39-29-17-7-18-30-39)45-49(73-38-27-15-6-16-28-38)52(87-59(64,65)66)47(69)42(51(45)86-56(61)62)36-23-11-4-12-24-36/h3-32,53,56,72-75H,34,68-69,71H2,1-2H3,(H,81,82)

InChI Key

QPMAIUAUCPPGTO-UHFFFAOYSA-N

Canonical SMILES

COC(C1=CC=CC=C1)N(C2=C(C(=C(C(=C2C(=O)O)NCC3=CC=CC=C3)C#N)N)C(N(C(C4=C(C(=C(C(=C4NC5=CC=CC=C5)OC(F)(F)F)N)C6=CC=CC=C6)OC(F)F)(C(=O)OC)NC7=CC=CC=C7)N)(N(N=[N+]=[N-])Cl)F)NC8=CC=CC=C8

别名