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

Systemtic Name: 4-(4-chlorophenyl)-2-oxidanyl-2-phenyl-3-pyridin-1-ium-1-yl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-chlorophenyl)-2-hydroxy-2-phenyl-3-pyridin-1-ium-1-yl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-chlorophenyl)-2-hydroxy-6-mercapto-2-phenyl-3-(1-pyridin-1-iumyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-chlorophenyl)-2-hydroxy-2-phenyl-3-pyridin-1-ium-1-yl-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-chlorophenyl)-2-hydroxy-6-mercapto-2-phenyl-3-pyridin-1-ium-1-yl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C23H19ClN3OS+ MolecularWeight: 420.93446

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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/p+1