propyl 4-[[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]amino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]amino]-4-oxo-butanoate CAS Name: 4-[[[N-methyl-2-[oxo-(phenethylamino)methyl]anilino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[methyl-[2-(phenethylcarbamoyl)phenyl]carbamothioyl]amino]-4-oxobutanoate Traditional Name: 4-keto-4-[[methyl-[2-(phenethylcarbamoyl)phenyl]thiocarbamoyl]amino]butyric acid propyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)N(C)C1=CC=CC=C1C(=O)NCCC2=CC=CC=C2

InChI

InChI=1S/C24H29N3O4S/c1-3-17-31-22(29)14-13-21(28)26-24(32)27(2)20-12-8-7-11-19(20)23(30)25-16-15-18-9-5-4-6-10-18/h4-12H,3,13-17H2,1-2H3,(H,25,30)(H,26,28,32)