ethyl 4-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]benzoate

Systemtic Name: ethyl 4-[(2,6-dimethylmorpholin-4-yl)carbothioylamino]benzoate Openeye Name: ethyl 4-[(2,6-dimethylmorpholine-4-carbothioyl)amino]benzoate CAS Name: 4-[[(2,6-dimethyl-4-morpholinyl)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,6-dimethylmorpholine-4-carbothioyl)amino]benzoate Traditional Name: 4-[(2,6-dimethylmorpholine-4-carbothioyl)amino]benzoic acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CC(OC(C2)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N2CC(OC(C2)C)C

InChI

InChI=1S/C16H22N2O3S/c1-4-20-15(19)13-5-7-14(8-6-13)17-16(22)18-9-11(2)21-12(3)10-18/h5-8,11-12H,4,9-10H2,1-3H3,(H,17,22)