2-methoxyethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(2,6-dimethylphenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(2,6-dimethylphenyl)thiocarbamoylamino]-4-keto-butyric acid 2-methoxyethyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)CCC(=O)OCCOC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NC(=O)CCC(=O)OCCOC

InChI

InChI=1S/C16H22N2O4S/c1-11-5-4-6-12(2)15(11)18-16(23)17-13(19)7-8-14(20)22-10-9-21-3/h4-6H,7-10H2,1-3H3,(H2,17,18,19,23)