ethyl 4-(benzamidocarbamothioylamino)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(benzamidocarbamothioylamino)-4-oxidanylidene-butanoate Openeye Name: ethyl 4-(benzamidocarbamothioylamino)-4-oxo-butanoate CAS Name: 4-[[(benzoylhydrazo)-sulfanylidenemethyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(benzamidocarbamothioylamino)-4-oxobutanoate Traditional Name: 4-(benzamidothiocarbamoylamino)-4-keto-butyric acid ethyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NNC(=O)C1=CC=CC=C1

InChI

InChI=1S/C14H17N3O4S/c1-2-21-12(19)9-8-11(18)15-14(22)17-16-13(20)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,16,20)(H2,15,17,18,22)