N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-hexyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: N-(6-bromanyl-1,3-benzothiazol-2-yl)-1-hexyl-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-hexyl-2-hydroxy-4-oxo-quinoline-3-carboxamide CAS Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-hexyl-2-hydroxy-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-hexyl-2-hydroxy-4-oxoquinoline-3-carboxamide Traditional Name: N-(6-bromo-1,3-benzothiazol-2-yl)-1-hexyl-2-hydroxy-4-keto-quinoline-3-carboxamide Formula: C23H22BrN3O3S MolecularWeight: 500.40808

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)Br

InChI

InChI=1S/C23H22BrN3O3S/c1-2-3-4-7-12-27-17-9-6-5-8-15(17)20(28)19(22(27)30)21(29)26-23-25-16-11-10-14(24)13-18(16)31-23/h5-6,8-11,13,30H,2-4,7,12H2,1H3,(H,25,26,29)