methyl 4-[[4-[ethanoyl(methyl)amino]phenyl]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[[4-[ethanoyl(methyl)amino]phenyl]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[[4-[acetyl(methyl)amino]phenyl]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[4-[acetyl(methyl)amino]anilino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[[4-[acetyl(methyl)amino]phenyl]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[[4-[acetyl(methyl)amino]phenyl]thiocarbamoylamino]-4-keto-butyric acid methyl ester Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OC

Isomeric SMILES

CC(=O)N(C)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OC

InChI

InChI=1S/C15H19N3O4S/c1-10(19)18(2)12-6-4-11(5-7-12)16-15(23)17-13(20)8-9-14(21)22-3/h4-7H,8-9H2,1-3H3,(H2,16,17,20,23)