ethyl 4-oxidanylidene-4-[(2-propan-2-yloxyphenyl)carbamothioylamino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[(2-propan-2-yloxyphenyl)carbamothioylamino]butanoate Openeye Name: ethyl 4-[(2-isopropoxyphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[(2-propan-2-yloxyanilino)-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[(2-propan-2-yloxyphenyl)carbamothioylamino]butanoate Traditional Name: 4-[(2-isopropoxyphenyl)thiocarbamoylamino]-4-keto-butyric acid ethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1OC(C)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=CC=CC=C1OC(C)C

InChI

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