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

Systemtic Name: 2-azanyl-4-phenyl-6-(2,4,6-trimethylphenyl)sulfanyl-pyridine-3,5-dicarbonitrile Openeye Name: 2-amino-4-phenyl-6-(2,4,6-trimethylphenyl)sulfanyl-pyridine-3,5-dicarbonitrile CAS Name: 2-amino-4-phenyl-6-[(2,4,6-trimethylphenyl)thio]pyridine-3,5-dicarbonitrile IUPAC Name: 2-amino-4-phenyl-6-(2,4,6-trimethylphenyl)sulfanylpyridine-3,5-dicarbonitrile Traditional Name: 2-amino-6-(mesitylthio)-4-phenyl-dinicotinonitrile Formula: C22H18N4S MolecularWeight: 370.47012

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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=CC=C3)C#N)C

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4S/c1-13-9-14(2)20(15(3)10-13)27-22-18(12-24)19(16-7-5-4-6-8-16)17(11-23)21(25)26-22/h4-10H,1-3H3,(H2,25,26)