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

Systemtic Name: N,N'-dipentyl-2-[[2-(phenylmethyl)-3-sulfanylidene-butanoyl]amino]propanediamide Openeye Name: 2-[(2-benzyl-3-thioxo-butanoyl)amino]-N,N'-dipentyl-propanediamide CAS Name: 2-[[1-oxo-2-(phenylmethyl)-3-sulfanylidenebutyl]amino]-N,N'-dipentylpropanediamide IUPAC Name: 2-[(2-benzyl-3-sulfanylidenebutanoyl)amino]-N,N'-dipentylpropanediamide Traditional Name: N,N'-diamyl-2-[(2-benzyl-3-thioxo-butanoyl)amino]malonamide Formula: C24H37N3O3S MolecularWeight: 447.63388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C(C(=O)NCCCCC)NC(=O)C(CC1=CC=CC=C1)C(=S)C

Isomeric SMILES

CCCCCNC(=O)C(C(=O)NCCCCC)NC(=O)C(CC1=CC=CC=C1)C(=S)C

InChI

InChI=1S/C24H37N3O3S/c1-4-6-11-15-25-23(29)21(24(30)26-16-12-7-5-2)27-22(28)20(18(3)31)17-19-13-9-8-10-14-19/h8-10,13-14,20-21H,4-7,11-12,15-17H2,1-3H3,(H,25,29)(H,26,30)(H,27,28)