(2S)-3-(1H-indol-3-yl)-N-{[1-(4-methoxyphenyl)cyclohexyl]methyl}-2-{[(4-nitrophenyl)carbamoyl]amino}propanamide

CAS: 1422269-30-4

Formula: C32H35N5O5

SMILES: COC1=CC=C(C=C1)C1(CNC(=O)[C@H](CC2=CNC3=CC=CC=C23)NC(=O)NC2=CC=C(C=C2)[N+]([O-])=O)CCCCC1

IUPAC: (2S)-3-(1H-indol-3-yl)-N-{[1-(4-methoxyphenyl)cyclohexyl]methyl}-2-{[(4-nitrophenyl)carbamoyl]amino}propanamide

InChI: InChI=1S/C32H35N5O5/c1-42-26-15-9-23(10-16-26)32(17-5-2-6-18-32)21-34-30(38)29(19-22-20-33-28-8-4-3-7-27(22)28)36-31(39)35-24-11-13-25(14-12-24)37(40)41/h3-4,7-16,20,29,33H,2,5-6,17-19,21H2,1H3,(H,34,38)(H2,35,36,39)/t29-/m0/s1

Composition: C (67.47%), H (6.19%), N (12.29%), O (14.04%)

Molar Mass: 569.662

Atom Count: 77

Heavy Atom Count: 42