N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide Openeye Name: N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide CAS Name: N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)-4-thiazolyl]methylthio]-4-quinolinecarboxamide IUPAC Name: N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]quinoline-4-carboxamide Traditional Name: N-cyclopropyl-2-[[2-(2,3-dimethoxyphenyl)thiazol-4-yl]methylthio]cinchoninamide Formula: C25H23N3O3S2 MolecularWeight: 477.59842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

Isomeric SMILES

COC1=CC=CC(=C1OC)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5

InChI

InChI=1S/C25H23N3O3S2/c1-30-21-9-5-7-18(23(21)31-2)25-27-16(14-33-25)13-32-22-12-19(24(29)26-15-10-11-15)17-6-3-4-8-20(17)28-22/h3-9,12,14-15H,10-11,13H2,1-2H3,(H,26,29)