methyl 4-[(4-ethoxy-4-oxidanylidene-butanoyl)carbamothioylamino]benzoate

Systemtic Name: methyl 4-[(4-ethoxy-4-oxidanylidene-butanoyl)carbamothioylamino]benzoate Openeye Name: methyl 4-[(4-ethoxy-4-oxo-butanoyl)carbamothioylamino]benzoate CAS Name: 4-[[[(4-ethoxy-1,4-dioxobutyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-ethoxy-4-oxobutanoyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-ethoxy-4-keto-butanoyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C15H18N2O5S MolecularWeight: 338.37882

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H18N2O5S/c1-3-22-13(19)9-8-12(18)17-15(23)16-11-6-4-10(5-7-11)14(20)21-2/h4-7H,3,8-9H2,1-2H3,(H2,16,17,18,23)