N-(5,7-dimethylquinolin-2-yl)-2-(diphenylmethyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-(5,7-dimethylquinolin-2-yl)-2-(diphenylmethyl)sulfanyl-pyridine-3-carboxamide Openeye Name: 2-benzhydrylsulfanyl-N-(5,7-dimethyl-2-quinolyl)pyridine-3-carboxamide CAS Name: N-(5,7-dimethyl-2-quinolinyl)-2-[(diphenylmethyl)thio]-3-pyridinecarboxamide IUPAC Name: 2-benzhydrylsulfanyl-N-(5,7-dimethylquinolin-2-yl)pyridine-3-carboxamide Traditional Name: 2-(benzhydrylthio)-N-(5,7-dimethyl-2-quinolyl)nicotinamide Formula: C30H25N3OS MolecularWeight: 475.604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=CC(=NC2=C1)NC(=O)C3=C(N=CC=C3)SC(C4=CC=CC=C4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C2C=CC(=NC2=C1)NC(=O)C3=C(N=CC=C3)SC(C4=CC=CC=C4)C5=CC=CC=C5)C

InChI

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