N-(1,3-benzothiazol-2-yl)-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: 1-amyl-N-(1,3-benzothiazol-2-yl)-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H21N3O3S/c1-2-3-8-13-25-16-11-6-4-9-14(16)19(26)18(21(25)28)20(27)24-22-23-15-10-5-7-12-17(15)29-22/h4-7,9-12,28H,2-3,8,13H2,1H3,(H,23,24,27)