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

Systemtic Name: methyl 4-[(4-ethoxy-4-oxidanylidene-butyl)carbamothioylamino]benzoate Openeye Name: methyl 4-[(4-ethoxy-4-oxo-butyl)carbamothioylamino]benzoate CAS Name: 4-[[[(4-ethoxy-4-oxobutyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-ethoxy-4-oxobutyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-ethoxy-4-keto-butyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCOC(=O)CCCNC(=S)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C15H20N2O4S/c1-3-21-13(18)5-4-10-16-15(22)17-12-8-6-11(7-9-12)14(19)20-2/h6-9H,3-5,10H2,1-2H3,(H2,16,17,22)