2-(2,5-dimethylphenyl)sulfanyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-(2-pyridylmethyl)pyridine-3-carboxamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-(2-pyridinylmethyl)-3-pyridinecarboxamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-(pyridin-2-ylmethyl)pyridine-3-carboxamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-(2-pyridylmethyl)nicotinamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=C(C=CC=N2)C(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C20H19N3OS/c1-14-8-9-15(2)18(12-14)25-20-17(7-5-11-22-20)19(24)23-13-16-6-3-4-10-21-16/h3-12H,13H2,1-2H3,(H,23,24)