N-[4,6-bis(chloranyl)-1,3-benzothiazol-2-yl]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide

Systemtic Name: N-[4,6-bis(chloranyl)-1,3-benzothiazol-2-yl]-2-oxidanyl-4-oxidanylidene-1-pentyl-quinoline-3-carboxamide Openeye Name: N-(4,6-dichloro-1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentyl-quinoline-3-carboxamide CAS Name: N-(4,6-dichloro-1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentyl-3-quinolinecarboxamide IUPAC Name: N-(4,6-dichloro-1,3-benzothiazol-2-yl)-2-hydroxy-4-oxo-1-pentylquinoline-3-carboxamide Traditional Name: 1-amyl-N-(4,6-dichloro-1,3-benzothiazol-2-yl)-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C22H19Cl2N3O3S MolecularWeight: 476.37556

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19Cl2N3O3S/c1-2-3-6-9-27-15-8-5-4-7-13(15)19(28)17(21(27)30)20(29)26-22-25-18-14(24)10-12(23)11-16(18)31-22/h4-5,7-8,10-11,30H,2-3,6,9H2,1H3,(H,25,26,29)