N-(3,5-dimethylphenyl)-2-(quinolin-3-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(quinolin-3-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-2-(3-quinolylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-2-(3-quinolinylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(quinolin-3-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-2-(3-quinolylmethylthio)nicotinamide Formula: C24H21N3OS MolecularWeight: 399.50804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C24H21N3OS/c1-16-10-17(2)12-20(11-16)27-23(28)21-7-5-9-25-24(21)29-15-18-13-19-6-3-4-8-22(19)26-14-18/h3-14H,15H2,1-2H3,(H,27,28)