ethyl 4-oxidanylidene-4-[(3-propoxyphenyl)carbamothioylamino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[(3-propoxyphenyl)carbamothioylamino]butanoate Openeye Name: ethyl 4-oxo-4-[(3-propoxyphenyl)carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[(3-propoxyanilino)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[(3-propoxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-[(3-propoxyphenyl)thiocarbamoylamino]butyric acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OCC

Isomeric SMILES

CCCOC1=CC=CC(=C1)NC(=S)NC(=O)CCC(=O)OCC

InChI

InChI=1S/C16H22N2O4S/c1-3-10-22-13-7-5-6-12(11-13)17-16(23)18-14(19)8-9-15(20)21-4-2/h5-7,11H,3-4,8-10H2,1-2H3,(H2,17,18,19,23)