N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6,8-dimethyl-2-(2-pyridyl)cinchoninamide Formula: C25H25N5OS MolecularWeight: 443.5639

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=NN=C(S4)C5CCCCC5)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)C3=CC=CC=N3)C(=O)NC4=NN=C(S4)C5CCCCC5)C

InChI

InChI=1S/C25H25N5OS/c1-15-12-16(2)22-18(13-15)19(14-21(27-22)20-10-6-7-11-26-20)23(31)28-25-30-29-24(32-25)17-8-4-3-5-9-17/h6-7,10-14,17H,3-5,8-9H2,1-2H3,(H,28,30,31)