N-butyl-2-[[3-methylbutyl(2-phenylsulfanylethyl)carbamoyl]amino]-3-(4-phenylphenyl)propanamide

Systemtic Name: N-butyl-2-[[3-methylbutyl(2-phenylsulfanylethyl)carbamoyl]amino]-3-(4-phenylphenyl)propanamide Openeye Name: N-butyl-2-[[isopentyl(2-phenylsulfanylethyl)carbamoyl]amino]-3-(4-phenylphenyl)propanamide CAS Name: N-butyl-2-[[[3-methylbutyl-[2-(phenylthio)ethyl]amino]-oxomethyl]amino]-3-(4-phenylphenyl)propanamide IUPAC Name: N-butyl-2-[[3-methylbutyl(2-phenylsulfanylethyl)carbamoyl]amino]-3-(4-phenylphenyl)propanamide Traditional Name: N-butyl-2-[[isoamyl-[2-(phenylthio)ethyl]carbamoyl]amino]-3-(4-phenylphenyl)propionamide Formula: C33H43N3O2S MolecularWeight: 545.77842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)N(CCC(C)C)CCSC3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)N(CCC(C)C)CCSC3=CC=CC=C3

InChI

InChI=1S/C33H43N3O2S/c1-4-5-21-34-32(37)31(25-27-16-18-29(19-17-27)28-12-8-6-9-13-28)35-33(38)36(22-20-26(2)3)23-24-39-30-14-10-7-11-15-30/h6-19,26,31H,4-5,20-25H2,1-3H3,(H,34,37)(H,35,38)