N-[2-(1H-indol-3-yl)ethyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)ethanamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-yl-amino]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[isopropyl-[(4-methylsulfanylphenyl)carbamoyl]amino]acetamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-2-[[[4-(methylthio)anilino]-oxomethyl]-propan-2-ylamino]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[(4-methylsulfanylphenyl)carbamoyl-propan-2-ylamino]acetamide Traditional Name: N-benzyl-N-[2-(1H-indol-3-yl)ethyl]-2-[isopropyl-[[4-(methylthio)phenyl]carbamoyl]amino]acetamide Formula: C30H34N4O2S MolecularWeight: 514.68156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C21)CC3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C30H34N4O2S/c1-22(2)34(30(36)32-25-13-15-26(37-3)16-14-25)21-29(35)33(20-23-9-5-4-6-10-23)18-17-24-19-31-28-12-8-7-11-27(24)28/h4-16,19,22,31H,17-18,20-21H2,1-3H3,(H,32,36)