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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CSC3=NC4=CC=CC=C4C(=C3)C(=O)NC5CC5)OC

InChI

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