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

Systemtic Name: N-(3,5-dimethylphenyl)-2-[[2-(methylcarbamoyl)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-2-[[2-(methylcarbamoyl)-4-pyridyl]methylsulfanyl]pyridine-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-2-[[2-(methylcarbamoyl)-4-pyridinyl]methylthio]-3-pyridinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-2-[[2-(methylcarbamoyl)pyridin-4-yl]methylsulfanyl]pyridine-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-2-[[2-(methylcarbamoyl)-4-pyridyl]methylthio]nicotinamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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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)C(=O)NC)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-14-9-15(2)11-17(10-14)26-20(27)18-5-4-7-25-22(18)29-13-16-6-8-24-19(12-16)21(28)23-3/h4-12H,13H2,1-3H3,(H,23,28)(H,26,27)