4-(4-chlorophenyl)-5-cyano-2-oxidanyl-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-6-thiolate

Systemtic Name: 4-(4-chlorophenyl)-5-cyano-2-oxidanyl-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-6-thiolate Openeye Name: 4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-6-thiolate CAS Name: 4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3-(1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridine-6-thiolate IUPAC Name: 4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-6-thiolate Traditional Name: 4-(4-chlorophenyl)-5-cyano-2-hydroxy-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-6-thiolate Formula: C23H18ClN3OS MolecularWeight: 419.92652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C(C(C(=C(N2)[S-])C#N)C3=CC=C(C=C3)Cl)[N+]4=CC=CC=C4)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C(C(C(=C(N2)[S-])C#N)C3=CC=C(C=C3)Cl)[N+]4=CC=CC=C4)O

InChI

InChI=1S/C23H18ClN3OS/c24-18-11-9-16(10-12-18)20-19(15-25)22(29)26-23(28,17-7-3-1-4-8-17)21(20)27-13-5-2-6-14-27/h1-14,20-21,26,28H