2-(3-ethoxyphenyl)-N-[5-(2-methylbutan-2-yl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-(3-ethoxyphenyl)-N-[5-(2-methylbutan-2-yl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide Openeye Name: N-[5-(1,1-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(3-ethoxyphenyl)quinoline-4-carboxamide CAS Name: 2-(3-ethoxyphenyl)-N-[5-(2-methylbutan-2-yl)-1,3,4-thiadiazol-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-(3-ethoxyphenyl)-N-[5-(2-methylbutan-2-yl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide Traditional Name: N-(5-tert-amyl-1,3,4-thiadiazol-2-yl)-2-m-phenetyl-cinchoninamide Formula: C25H26N4O2S MolecularWeight: 446.56454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OCC

Isomeric SMILES

CCC(C)(C)C1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)OCC

InChI

InChI=1S/C25H26N4O2S/c1-5-25(3,4)23-28-29-24(32-23)27-22(30)19-15-21(26-20-13-8-7-12-18(19)20)16-10-9-11-17(14-16)31-6-2/h7-15H,5-6H2,1-4H3,(H,27,29,30)