N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(4,6-dimethyl-2-oxidanylidene-1H-pyridin-3-yl)methyl]-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-[(2-keto-4,6-dimethyl-1H-pyridin-3-yl)methyl]-2-(2-thienyl)cinchoninamide Formula: C22H19N3O2S MolecularWeight: 389.47016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C

Isomeric SMILES

CC1=CC(=C(C(=O)N1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CS4)C

InChI

InChI=1S/C22H19N3O2S/c1-13-10-14(2)24-22(27)17(13)12-23-21(26)16-11-19(20-8-5-9-28-20)25-18-7-4-3-6-15(16)18/h3-11H,12H2,1-2H3,(H,23,26)(H,24,27)