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

Systemtic Name: N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: 2-hydroxy-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: 2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: 1-amyl-2-hydroxy-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-keto-quinoline-3-carboxamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NN=C(S3)CC(C)C

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NN=C(S3)CC(C)C

InChI

InChI=1S/C21H26N4O3S/c1-4-5-8-11-25-15-10-7-6-9-14(15)18(26)17(20(25)28)19(27)22-21-24-23-16(29-21)12-13(2)3/h6-7,9-10,13,28H,4-5,8,11-12H2,1-3H3,(H,22,24,27)