2-methoxyethyl 4-[(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: 2-methoxyethyl 4-[(3-cyano-4,6-dimethyl-2-oxidanylidene-pyridin-1-yl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: 2-methoxyethyl 4-[(3-cyano-4,6-dimethyl-2-oxo-1-pyridyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[(3-cyano-4,6-dimethyl-2-oxo-1-pyridinyl)amino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-[(3-cyano-4,6-dimethyl-2-oxopyridin-1-yl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(3-cyano-2-keto-4,6-dimethyl-1-pyridyl)thiocarbamoylamino]-4-keto-butyric acid 2-methoxyethyl ester Formula: C16H20N4O5S MolecularWeight: 380.4188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1NC(=S)NC(=O)CCC(=O)OCCOC)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1NC(=S)NC(=O)CCC(=O)OCCOC)C#N)C

InChI

InChI=1S/C16H20N4O5S/c1-10-8-11(2)20(15(23)12(10)9-17)19-16(26)18-13(21)4-5-14(22)25-7-6-24-3/h8H,4-7H2,1-3H3,(H2,18,19,21,26)