[(4S)-5-cyano-2-methyl-4-pyridin-3-yl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate

Systemtic Name: [(4S)-5-cyano-2-methyl-4-pyridin-3-yl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate Openeye Name: [(4S)-5-cyano-2-methyl-4-(3-pyridyl)-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate CAS Name: [(4S)-5-cyano-6-mercapto-2-methyl-4-(3-pyridinyl)-4H-pyridin-3-ylidene]-methoxymethanolate IUPAC Name: [(4S)-5-cyano-2-methyl-4-pyridin-3-yl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxymethanolate Traditional Name: [(4S)-5-cyano-6-mercapto-2-methyl-4-(3-pyridyl)-4H-pyridin-3-ylidene]-methoxy-methanolate Formula: C14H12N3O2S- MolecularWeight: 286.32898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O2S/c1-8-11(14(18)19-2)12(9-4-3-5-16-7-9)10(6-15)13(20)17-8/h3-5,7,12,18,20H,1-2H3/p-1/t12-/m1/s1