4-(4-chlorophenyl)-3-(2-methylpyridin-1-ium-1-yl)-2-oxidanyl-2-phenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 4-(4-chlorophenyl)-3-(2-methylpyridin-1-ium-1-yl)-2-oxidanyl-2-phenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-hydroxy-3-(2-methylpyridin-1-ium-1-yl)-2-phenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-hydroxy-6-mercapto-3-(2-methyl-1-pyridin-1-iumyl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-hydroxy-3-(2-methylpyridin-1-ium-1-yl)-2-phenyl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-hydroxy-6-mercapto-3-(2-methylpyridin-1-ium-1-yl)-2-phenyl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C24H21ClN3OS+ MolecularWeight: 434.96104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=[N+]1C2C(C(=C(NC2(C3=CC=CC=C3)O)S)C#N)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=CC=[N+]1C2C(C(=C(NC2(C3=CC=CC=C3)O)S)C#N)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H20ClN3OS/c1-16-7-5-6-14-28(16)22-21(17-10-12-19(25)13-11-17)20(15-26)23(30)27-24(22,29)18-8-3-2-4-9-18/h2-14,21-22,27,29H,1H3/p+1