化学式

CAS号

IUPAC Name

3-[3-[4-[[3-[4-[4-[[4-[氯(甲基)氨基]环己基]氨基甲酰]-2-(三氟甲基)苯基]苯基]-2-[[4-[[(2-甲基-2-基)oxycarbonylamino]甲基]环己烷羰基]氨基]丙酰基]氨基]苯基]-1H-1,2,4-三唑-5-基]-2,2,3,3-四氟丙酸 3-[3-[4-[[3-[4-[4-[[4-[chloro(methyl)amino]cyclohexyl]carbamoyl]-2-(trifluoromethyl)phenyl]phenyl]-2-[[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]cyclohexanecarbonyl]amino]propanoyl]amino]phenyl]-1H-1,2,4-triazol-5-yl]-2,2,3,3-tetrafluoropropanoic acid

InChI

InChI=1S/C48H54ClF7N8O7/c1-45(2,3)71-44(70)57-25-27-7-11-30(12-8-27)39(65)60-37(41(67)59-32-16-13-29(14-17-32)38-61-42(63-62-38)46(50,51)47(52,53)43(68)69)23-26-5-9-28(10-6-26)35-22-15-31(24-36(35)48(54,55)56)40(66)58-33-18-20-34(21-19-33)64(4)49/h5-6,9-10,13-17,22,24,27,30,33-34,37H,7-8,11-12,18-21,23,25H2,1-4H3,(H,57,70)(H,58,66)(H,59,67)(H,60,65)(H,68,69)(H,61,62,63)

InChI Key

VNHCPWBTSWFWNP-UHFFFAOYSA-N

Canonical SMILES

CC(C)(C)OC(=O)NCC1CCC(CC1)C(=O)NC(CC2=CC=C(C=C2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N(C)Cl)C(F)(F)F)C(=O)NC5=CC=C(C=C5)C6=NNC(=N6)C(C(C(=O)O)(F)F)(F)F

别名

• SCHEMBL16607701