N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-2-(4-quinolylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-2-(4-quinolinylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(quinolin-4-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-2-(4-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=CC=NC4=CC=CC=C34)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC=NC4=CC=CC=C34)C

InChI

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