2-[[2-(dimethylamino)pyridin-4-yl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide

Systemtic Name: 2-[[2-(dimethylamino)pyridin-4-yl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide Openeye Name: 2-[[2-(dimethylamino)-4-pyridyl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide CAS Name: 2-[[2-(dimethylamino)-4-pyridinyl]methylthio]-N-(3,5-dimethylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[[2-(dimethylamino)pyridin-4-yl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide Traditional Name: 2-[[2-(dimethylamino)-4-pyridyl]methylthio]-N-(3,5-dimethylphenyl)nicotinamide Formula: C22H24N4OS MolecularWeight: 392.51716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)N(C)C)C

InChI

InChI=1S/C22H24N4OS/c1-15-10-16(2)12-18(11-15)25-21(27)19-6-5-8-24-22(19)28-14-17-7-9-23-20(13-17)26(3)4/h5-13H,14H2,1-4H3,(H,25,27)