ethyl 4-[[(3-chlorophenyl)carbonylamino]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[(3-chlorophenyl)carbonylamino]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[(3-chlorobenzoyl)amino]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[[(3-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[(3-chlorobenzoyl)amino]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[[(3-chlorobenzoyl)amino]thiocarbamoylamino]-4-keto-butyric acid ethyl ester Formula: C14H16ClN3O4S MolecularWeight: 357.81254

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16ClN3O4S/c1-2-22-12(20)7-6-11(19)16-14(23)18-17-13(21)9-4-3-5-10(15)8-9/h3-5,8H,2,6-7H2,1H3,(H,17,21)(H2,16,18,19,23)