(3S)-7-[[(2S)-2-(benzenesulfonamido)-3-(1H-indol-3-yl)propanoyl]amino]-3-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]heptanoic acid

Molecular Formula: C35H44N4O7S2


InChI: InChI=1/C35H44N4O7S2/c1-25(2)24-39(48(45,46)30-18-16-26(3)17-19-30)28(22-34(40)41)11-9-10-20-36-35(42)33(38-47(43,44)29-12-5-4-6-13-29)21-27-23-37-32-15-8-7-14-31(27)32/h4-8,12-19,23,25,28,33,37-38H,9-11,20-22,24H2,1-3H3,(H,36,42)(H,40,41)/t28-,33-/m0/s1/f/h36,40H

InChIKey: InChIKey=YBMQDQYGJMOVGH-JSVSYKBFDX
SMILES: CC1=CC=C(C=C1)S(=O)(=O)N(CC(C)C)C(CCCCNC(=O)C(CC2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=CC=C4)CC(=O)O

Names:
    (3S)-7-[[(2S)-2-(benzenesulfonamido)-3-(1H-indol-3-yl)propanoyl]amino]-3-[(4-methylphenyl)sulfonyl-(2-methylpropyl)amino]heptanoic acid

Registries:
    PubChem CID 10168948
    PubChem ID 15162037