methyl 4-oxidanylidene-4-[[2-(phenylcarbamoyl)phenyl]carbamothioylamino]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[[2-(phenylcarbamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: methyl 4-oxo-4-[[2-(phenylcarbamoyl)phenyl]carbamothioylamino]butanoate CAS Name: 4-[[[2-[anilino(oxo)methyl]anilino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[[2-(phenylcarbamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[2-(phenylcarbamoyl)phenyl]thiocarbamoylamino]butyric acid methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C19H19N3O4S/c1-26-17(24)12-11-16(23)22-19(27)21-15-10-6-5-9-14(15)18(25)20-13-7-3-2-4-8-13/h2-10H,11-12H2,1H3,(H,20,25)(H2,21,22,23,27)