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

Systemtic Name: 1-hexyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-hexyl-2-hydroxy-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-oxo-quinoline-3-carboxamide CAS Name: 1-hexyl-2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-hexyl-2-hydroxy-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-oxoquinoline-3-carboxamide Traditional Name: 1-hexyl-2-hydroxy-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)-4-keto-quinoline-3-carboxamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NN=C(S3)CC(C)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NN=C(S3)CC(C)C

InChI

InChI=1S/C22H28N4O3S/c1-4-5-6-9-12-26-16-11-8-7-10-15(16)19(27)18(21(26)29)20(28)23-22-25-24-17(30-22)13-14(2)3/h7-8,10-11,14,29H,4-6,9,12-13H2,1-3H3,(H,23,25,28)