2-azanyl-4-cyclohexyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-cyclohexyl-6-[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-cyclohexyl-6-[2-(4-methoxyphenyl)-2-oxo-ethyl]sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-cyclohexyl-6-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-cyclohexyl-6-[2-(4-methoxyphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-cyclohexyl-6-[[2-keto-2-(4-methoxyphenyl)ethyl]thio]dinicotinonitrile Formula: C22H22N4O2S MolecularWeight: 406.50068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=C(C(=N2)N)C#N)C3CCCCC3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)CSC2=C(C(=C(C(=N2)N)C#N)C3CCCCC3)C#N

InChI

InChI=1S/C22H22N4O2S/c1-28-16-9-7-14(8-10-16)19(27)13-29-22-18(12-24)20(15-5-3-2-4-6-15)17(11-23)21(25)26-22/h7-10,15H,2-6,13H2,1H3,(H2,25,26)