NSC80459

Molecular Formula: C29H29N3O5S


InChI: InChI=1/C29H29N3O5S/c33-27(31-26(28(34)35)19-38-18-21-11-5-2-6-12-21)25(15-22-16-30-24-14-8-7-13-23(22)24)32-29(36)37-17-20-9-3-1-4-10-20/h1-14,16,25-26,30H,15,17-19H2,(H,31,33)(H,32,36)(H,34,35)/f/h31-32,34H

InChIKey: InChIKey=SQQKSKNZVZCELS-FSDJKJBSCD
SMILES: C1=CC=C(C=C1)COC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NC(CSCC4=CC=CC=C4)C(=O)O

Names:
    NSC80459
    17445-48-6
    3-benzylsulfanyl-2-[[3-(1H-indol-3-yl)-2-phenylmethoxycarbonylamino-propanoyl]amino]propanoic acid

Registries:
    PubChem CID 255183
    PubChem ID 119882