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

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-2-(4-pyridyl)cinchoninamide Formula: C21H19N5OS MolecularWeight: 389.47346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CC(C)CC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C21H19N5OS/c1-13(2)11-19-25-26-21(28-19)24-20(27)16-12-18(14-7-9-22-10-8-14)23-17-6-4-3-5-15(16)17/h3-10,12-13H,11H2,1-2H3,(H,24,26,27)