6-(4-bromophenyl)-2-(2-oxidanylcyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-bromophenyl)-2-(2-oxidanylcyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 6-(4-bromophenyl)-2-(2-hydroxycyclohexyl)sulfanyl-4-phenyl-pyridine-3-carbonitrile CAS Name: 6-(4-bromophenyl)-2-[(2-hydroxycyclohexyl)thio]-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 6-(4-bromophenyl)-2-(2-hydroxycyclohexyl)sulfanyl-4-phenylpyridine-3-carbonitrile Traditional Name: 6-(4-bromophenyl)-2-[(2-hydroxycyclohexyl)thio]-4-phenyl-nicotinonitrile Formula: C24H21BrN2OS MolecularWeight: 465.40534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)O)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC(C(C1)O)SC2=C(C(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H21BrN2OS/c25-18-12-10-17(11-13-18)21-14-19(16-6-2-1-3-7-16)20(15-26)24(27-21)29-23-9-5-4-8-22(23)28/h1-3,6-7,10-14,22-23,28H,4-5,8-9H2