2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(p-tolylsulfanyl)-N-(3-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-[(4-methylphenyl)thio]-N-(3-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-(pyridin-3-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(p-tolylthio)-N-(3-pyridylmethyl)cinchoninamide Formula: C23H19N3OS MolecularWeight: 385.48146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C23H19N3OS/c1-16-8-10-18(11-9-16)28-22-13-20(19-6-2-3-7-21(19)26-22)23(27)25-15-17-5-4-12-24-14-17/h2-14H,15H2,1H3,(H,25,27)