2-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)propanamide

Systemtic Name: 2-(6-azanyl-3,5-dicyano-4-phenyl-pyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)propanamide Openeye Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)sulfanyl]-N-(2,3-dimethylphenyl)propanamide CAS Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridinyl)thio]-N-(2,3-dimethylphenyl)propanamide IUPAC Name: 2-(6-amino-3,5-dicyano-4-phenylpyridin-2-yl)sulfanyl-N-(2,3-dimethylphenyl)propanamide Traditional Name: 2-[(6-amino-3,5-dicyano-4-phenyl-2-pyridyl)thio]-N-(2,3-dimethylphenyl)propionamide Formula: C24H21N5OS MolecularWeight: 427.52144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21N5OS/c1-14-8-7-11-20(15(14)2)28-23(30)16(3)31-24-19(13-26)21(17-9-5-4-6-10-17)18(12-25)22(27)29-24/h4-11,16H,1-3H3,(H2,27,29)(H,28,30)