化学式

CAS号

IUPAC Name

(5S,8S,10aR)-N-二苯甲基-5-[[(2S)-2-[氯(甲基)氨基]丙酰基]氨基]-3-[2-(4-氟苯基)乙酰基]-6-氧代-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocine-8-羧酰胺 (5S,8S,10aR)-N-benzhydryl-5-[[(2S)-2-[chloro(methyl)amino]propanoyl]amino]-3-[2-(4-fluorophenyl)acetyl]-6-oxo-1,2,4,5,8,9,10,10a-octahydropyrrolo[1,2-a][1,5]diazocine-8-carboxamide

InChI

InChI=1S/C35H39ClFN5O4/c1-23(40(2)36)33(44)38-29-22-41(31(43)21-24-13-15-27(37)16-14-24)20-19-28-17-18-30(42(28)35(29)46)34(45)39-32(25-9-5-3-6-10-25)26-11-7-4-8-12-26/h3-16,23,28-30,32H,17-22H2,1-2H3,(H,38,44)(H,39,45)/t23-,28+,29-,30-/m0/s1

InChI Key

WITYVACSFUTOLV-UUAGDVGUSA-N

Canonical SMILES

CC(C(=O)NC1CN(CCC2CCC(N2C1=O)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)CC5=CC=C(C=C5)F)N(C)Cl

别名

• SCHEMBL15850491