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

Systemtic Name: N-(6-fluoranyl-1,3-benzothiazol-2-yl)-1-(2-methylpropyl)-2-oxidanyl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-hydroxy-1-isobutyl-4-oxo-quinoline-3-carboxamide CAS Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-hydroxy-1-(2-methylpropyl)-4-oxo-3-quinolinecarboxamide IUPAC Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-hydroxy-1-(2-methylpropyl)-4-oxoquinoline-3-carboxamide Traditional Name: N-(6-fluoro-1,3-benzothiazol-2-yl)-2-hydroxy-1-isobutyl-4-keto-quinoline-3-carboxamide Formula: C21H18FN3O3S MolecularWeight: 411.449323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2C(=O)C(=C1O)C(=O)NC3=NC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C21H18FN3O3S/c1-11(2)10-25-15-6-4-3-5-13(15)18(26)17(20(25)28)19(27)24-21-23-14-8-7-12(22)9-16(14)29-21/h3-9,11,28H,10H2,1-2H3,(H,23,24,27)