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

Systemtic Name: 2-[[2-(cyclopropylamino)pyridin-4-yl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide Openeye Name: 2-[[2-(cyclopropylamino)-4-pyridyl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide CAS Name: 2-[[2-(cyclopropylamino)-4-pyridinyl]methylthio]-N-(3,5-dimethylphenyl)-3-pyridinecarboxamide IUPAC Name: 2-[[2-(cyclopropylamino)pyridin-4-yl]methylsulfanyl]-N-(3,5-dimethylphenyl)pyridine-3-carboxamide Traditional Name: 2-[[2-(cyclopropylamino)-4-pyridyl]methylthio]-N-(3,5-dimethylphenyl)nicotinamide Formula: C23H24N4OS MolecularWeight: 404.52786

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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)NC4CC4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC(=NC=C3)NC4CC4)C

InChI

InChI=1S/C23H24N4OS/c1-15-10-16(2)12-19(11-15)27-22(28)20-4-3-8-25-23(20)29-14-17-7-9-24-21(13-17)26-18-5-6-18/h3-4,7-13,18H,5-6,14H2,1-2H3,(H,24,26)(H,27,28)