ethyl 4-oxidanylidene-4-[(3-prop-2-enoxyphenyl)carbamothioylamino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[(3-prop-2-enoxyphenyl)carbamothioylamino]butanoate Openeye Name: ethyl 4-[(3-allyloxyphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[(3-prop-2-enoxyanilino)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[(3-prop-2-enoxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-[(3-allyloxyphenyl)thiocarbamoylamino]-4-keto-butyric acid ethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O4S/c1-3-10-22-13-7-5-6-12(11-13)17-16(23)18-14(19)8-9-15(20)21-4-2/h3,5-7,11H,1,4,8-10H2,2H3,(H2,17,18,19,23)