6-(4-methoxyphenyl)-2-[3-[(4-methylphenyl)amino]-2-oxidanyl-propyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile

Systemtic Name: 6-(4-methoxyphenyl)-2-[3-[(4-methylphenyl)amino]-2-oxidanyl-propyl]sulfanyl-4-phenyl-pyridine-3-carbonitrile Openeye Name: 2-[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl-6-(4-methoxyphenyl)-4-phenyl-pyridine-3-carbonitrile CAS Name: 2-[[2-hydroxy-3-(4-methylanilino)propyl]thio]-6-(4-methoxyphenyl)-4-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-[2-hydroxy-3-(4-methylanilino)propyl]sulfanyl-6-(4-methoxyphenyl)-4-phenylpyridine-3-carbonitrile Traditional Name: 2-[[2-hydroxy-3-(p-toluidino)propyl]thio]-6-(4-methoxyphenyl)-4-phenyl-nicotinonitrile Formula: C29H27N3O2S MolecularWeight: 481.60858

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC(CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CC=C4)C#N)O

Isomeric SMILES

CC1=CC=C(C=C1)NCC(CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=CC=C4)C#N)O

InChI

InChI=1S/C29H27N3O2S/c1-20-8-12-23(13-9-20)31-18-24(33)19-35-29-27(17-30)26(21-6-4-3-5-7-21)16-28(32-29)22-10-14-25(34-2)15-11-22/h3-16,24,31,33H,18-19H2,1-2H3