methyl 2-cyano-2-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-phenyl-ethanimidothioate

Systemtic Name: methyl 2-cyano-2-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-N-phenyl-ethanimidothioate Openeye Name: methyl 2-cyano-2-(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-N-phenyl-ethanimidothioate CAS Name: 2-cyano-2-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-N-phenylethanimidothioic acid methyl ester IUPAC Name: methyl 2-cyano-2-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-N-phenylethanimidothioate Traditional Name: 2-cyano-2-(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)-N-phenyl-thioacetimidic acid methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C#N)C(=NC2=CC=CC=C2)SC)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=C(C#N)C(=NC2=CC=CC=C2)SC)C=C(C1=O)OC

InChI

InChI=1S/C18H16N2O3S/c1-22-15-9-12(10-16(23-2)17(15)21)14(11-19)18(24-3)20-13-7-5-4-6-8-13/h4-10H,1-3H3