4,6-bis(4-methoxyphenyl)-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4,6-bis(4-methoxyphenyl)-2-[2-oxidanylidene-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-pyridine-3-carbonitrile Openeye Name: 4,6-bis(4-methoxyphenyl)-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanyl-pyridine-3-carbonitrile CAS Name: 4,6-bis(4-methoxyphenyl)-2-[[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]thio]-3-pyridinecarbonitrile IUPAC Name: 4,6-bis(4-methoxyphenyl)-2-[2-oxo-2-(2,4,5-trimethylphenyl)ethyl]sulfanylpyridine-3-carbonitrile Traditional Name: 2-[[2-keto-2-(2,4,5-trimethylphenyl)ethyl]thio]-4,6-bis(4-methoxyphenyl)nicotinonitrile Formula: C31H28N2O3S MolecularWeight: 508.63062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C#N)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=C(C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)C#N)C)C

InChI

InChI=1S/C31H28N2O3S/c1-19-14-21(3)26(15-20(19)2)30(34)18-37-31-28(17-32)27(22-6-10-24(35-4)11-7-22)16-29(33-31)23-8-12-25(36-5)13-9-23/h6-16H,18H2,1-5H3