2-azanyl-4-(4-chlorophenyl)-6-(2,4,6-trimethylphenyl)sulfanyl-pyridine-3,5-dicarbonitrile

Systemtic Name: 2-azanyl-4-(4-chlorophenyl)-6-(2,4,6-trimethylphenyl)sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-(4-chlorophenyl)-6-(2,4,6-trimethylphenyl)sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-(4-chlorophenyl)-6-[(2,4,6-trimethylphenyl)thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-(4-chlorophenyl)-6-(2,4,6-trimethylphenyl)sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-4-(4-chlorophenyl)-6-(mesitylthio)dinicotinonitrile Formula: C22H17ClN4S MolecularWeight: 404.91518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SC2=C(C(=C(C(=N2)N)C#N)C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C22H17ClN4S/c1-12-8-13(2)20(14(3)9-12)28-22-18(11-25)19(17(10-24)21(26)27-22)15-4-6-16(23)7-5-15/h4-9H,1-3H3,(H2,26,27)