(Z)-[4-(3-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate; piperidin-1-ium

Systemtic Name: (Z)-[4-(3-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate; piperidin-1-ium Openeye Name: (Z)-[4-(3-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxy-methanolate; piperidin-1-ium CAS Name: (Z)-[4-(3-chlorophenyl)-5-cyano-6-mercapto-2-methyl-4H-pyridin-3-ylidene]-methoxymethanolate; piperidin-1-ium IUPAC Name: (Z)-[4-(3-chlorophenyl)-5-cyano-2-methyl-6-sulfanyl-4H-pyridin-3-ylidene]-methoxymethanolate; piperidin-1-ium Traditional Name: (Z)-[4-(3-chlorophenyl)-5-cyano-6-mercapto-2-methyl-4H-pyridin-3-ylidene]-methoxy-methanolate; piperidin-1-ium Formula: C20H24ClN3O2S MolecularWeight: 405.94146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1=C([O-])OC)C2=CC(=CC=C2)Cl)C#N)S.C1CC[NH2+]CC1

Isomeric SMILES

CC\1=NC(=C(C(/C1=C(\[O-])/OC)C2=CC(=CC=C2)Cl)C#N)S.C1CC[NH2+]CC1

InChI

InChI=1S/C15H13ClN2O2S.C5H11N/c1-8-12(15(19)20-2)13(11(7-17)14(21)18-8)9-4-3-5-10(16)6-9;1-2-4-6-5-3-1/h3-6,13,19,21H,1-2H3;6H,1-5H2/b15-12+;