[(4R)-5-cyano-4-(4-methoxycarbonylphenyl)-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-prop-2-enoxy-methanolate

Systemtic Name: [(4R)-5-cyano-4-(4-methoxycarbonylphenyl)-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-prop-2-enoxy-methanolate Openeye Name: allyloxy-[(4R)-5-cyano-4-(4-methoxycarbonylphenyl)-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]methanolate CAS Name: [(4R)-5-cyano-6-mercapto-4-(4-methoxycarbonylphenyl)-2-methyl-4H-pyridin-3-ylidene]-prop-2-enoxymethanolate IUPAC Name: [(4R)-5-cyano-4-(4-methoxycarbonylphenyl)-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-prop-2-enoxymethanolate Traditional Name: allyloxy-[(4R)-4-(4-carbomethoxyphenyl)-5-cyano-6-mercapto-2-methyl-4H-pyridin-3-ylidene]methanolate Formula: C19H17N2O4S- MolecularWeight: 369.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1=C([O-])OCC=C)C2=CC=C(C=C2)C(=O)OC)C#N)S

Isomeric SMILES

CC1=NC(=C([C@@H](C1=C([O-])OCC=C)C2=CC=C(C=C2)C(=O)OC)C#N)S

InChI

InChI=1S/C19H18N2O4S/c1-4-9-25-19(23)15-11(2)21-17(26)14(10-20)16(15)12-5-7-13(8-6-12)18(22)24-3/h4-8,16,23,26H,1,9H2,2-3H3/p-1/t16-/m0/s1