2-[bis(4-methylphenyl)methylsulfanyl]-N-quinolin-5-yl-pyridine-3-carboxamide

Systemtic Name: 2-[bis(4-methylphenyl)methylsulfanyl]-N-quinolin-5-yl-pyridine-3-carboxamide Openeye Name: 2-(bis-p-tolylmethylsulfanyl)-N-(5-quinolyl)pyridine-3-carboxamide CAS Name: 2-[bis(4-methylphenyl)methylthio]-N-(5-quinolinyl)-3-pyridinecarboxamide IUPAC Name: 2-[bis(4-methylphenyl)methylsulfanyl]-N-quinolin-5-ylpyridine-3-carboxamide Traditional Name: 2-(bis-p-tolylmethylthio)-N-(5-quinolyl)nicotinamide Formula: C30H25N3OS MolecularWeight: 475.604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)SC3=C(C=CC=N3)C(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=C(C=C2)C)SC3=C(C=CC=N3)C(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C30H25N3OS/c1-20-10-14-22(15-11-20)28(23-16-12-21(2)13-17-23)35-30-25(7-5-19-32-30)29(34)33-27-9-3-8-26-24(27)6-4-18-31-26/h3-19,28H,1-2H3,(H,33,34)