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

Systemtic Name: N,N'-diphenethyl-2-[[2-(phenylmethyl)-3-sulfanylidene-butanoyl]amino]propanediamide Openeye Name: 2-[(2-benzyl-3-thioxo-butanoyl)amino]-N,N'-diphenethyl-propanediamide CAS Name: 2-[[1-oxo-2-(phenylmethyl)-3-sulfanylidenebutyl]amino]-N,N'-diphenethylpropanediamide IUPAC Name: 2-[(2-benzyl-3-sulfanylidenebutanoyl)amino]-N,N'-diphenethylpropanediamide Traditional Name: 2-[(2-benzyl-3-thioxo-butanoyl)amino]-N,N'-diphenethyl-malonamide Formula: C30H33N3O3S MolecularWeight: 515.66632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=S)C(CC1=CC=CC=C1)C(=O)NC(C(=O)NCCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(=S)C(CC1=CC=CC=C1)C(=O)NC(C(=O)NCCC2=CC=CC=C2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C30H33N3O3S/c1-22(37)26(21-25-15-9-4-10-16-25)28(34)33-27(29(35)31-19-17-23-11-5-2-6-12-23)30(36)32-20-18-24-13-7-3-8-14-24/h2-16,26-27H,17-21H2,1H3,(H,31,35)(H,32,36)(H,33,34)