N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(5-pentyl-1,3,4-thiadiazol-2-yl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-2-(3-pyridyl)cinchoninamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CN=CC=C4

InChI

InChI=1S/C22H21N5OS/c1-2-3-4-11-20-26-27-22(29-20)25-21(28)17-13-19(15-8-7-12-23-14-15)24-18-10-6-5-9-16(17)18/h5-10,12-14H,2-4,11H2,1H3,(H,25,27,28)