N,N'-diphenethyl-2-[(2-phenethyl-3-sulfanylidene-butanoyl)amino]propanediamide

Systemtic Name: N,N'-diphenethyl-2-[(2-phenethyl-3-sulfanylidene-butanoyl)amino]propanediamide Openeye Name: N,N'-diphenethyl-2-[(2-phenethyl-3-thioxo-butanoyl)amino]propanediamide CAS Name: 2-[(1-oxo-2-phenethyl-3-sulfanylidenebutyl)amino]-N,N'-diphenethylpropanediamide IUPAC Name: N,N'-diphenethyl-2-[(2-phenethyl-3-sulfanylidenebutanoyl)amino]propanediamide Traditional Name: N,N'-diphenethyl-2-[(2-phenethyl-3-thioxo-butanoyl)amino]malonamide Formula: C31H35N3O3S MolecularWeight: 529.6929

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)C(CCC1=CC=CC=C1)C(=O)NC(C(=O)NCCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(=S)C(CCC1=CC=CC=C1)C(=O)NC(C(=O)NCCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C31H35N3O3S/c1-23(38)27(18-17-24-11-5-2-6-12-24)29(35)34-28(30(36)32-21-19-25-13-7-3-8-14-25)31(37)33-22-20-26-15-9-4-10-16-26/h2-16,27-28H,17-22H2,1H3,(H,32,36)(H,33,37)(H,34,35)