2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-3-yl-benzamide

Systemtic Name: 2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-3-yl-benzamide Openeye Name: 2-(4-pyridylmethylsulfanyl)-N-(3-quinolyl)benzamide CAS Name: 2-(pyridin-4-ylmethylthio)-N-(3-quinolinyl)benzamide IUPAC Name: 2-(pyridin-4-ylmethylsulfanyl)-N-quinolin-3-ylbenzamide Traditional Name: 2-(4-pyridylmethylthio)-N-(3-quinolyl)benzamide Formula: C22H17N3OS MolecularWeight: 371.45488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC=CC=C3SCC4=CC=NC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=N2)NC(=O)C3=CC=CC=C3SCC4=CC=NC=C4

InChI

InChI=1S/C22H17N3OS/c26-22(25-18-13-17-5-1-3-7-20(17)24-14-18)19-6-2-4-8-21(19)27-15-16-9-11-23-12-10-16/h1-14H,15H2,(H,25,26)