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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCNC1=NC=CC(=C1)CSC2=C(C=CC=N2)C(=O)NC3=CC(=CC(=C3)C)C

InChI

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