N-(3,5-dimethylphenyl)-2-(quinolin-6-ylmethylsulfanyl)pyridine-3-carboxamide

Systemtic Name: N-(3,5-dimethylphenyl)-2-(quinolin-6-ylmethylsulfanyl)pyridine-3-carboxamide Openeye Name: N-(3,5-dimethylphenyl)-2-(6-quinolylmethylsulfanyl)pyridine-3-carboxamide CAS Name: N-(3,5-dimethylphenyl)-2-(6-quinolinylmethylthio)-3-pyridinecarboxamide IUPAC Name: N-(3,5-dimethylphenyl)-2-(quinolin-6-ylmethylsulfanyl)pyridine-3-carboxamide Traditional Name: N-(3,5-dimethylphenyl)-2-(6-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=C(C=C3)N=CC=C4)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)C2=C(N=CC=C2)SCC3=CC4=C(C=C3)N=CC=C4)C

InChI

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