4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-methylbutyl)-3-oxidanylidene-1,4-benzothiazine-6-carboxamide

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(3-methylbutyl)-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl]-N-isopentyl-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methylbutyl)-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-(3-methylbutyl)-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2-chloro-6-fluoro-benzyl)-N-isoamyl-3-keto-1,4-benzothiazine-6-carboxamide Formula: C21H22ClFN2O2S MolecularWeight: 420.927983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=C(C=CC=C3Cl)F

Isomeric SMILES

CC(C)CCNC(=O)C1=CC2=C(C=C1)SCC(=O)N2CC3=C(C=CC=C3Cl)F

InChI

InChI=1S/C21H22ClFN2O2S/c1-13(2)8-9-24-21(27)14-6-7-19-18(10-14)25(20(26)12-28-19)11-15-16(22)4-3-5-17(15)23/h3-7,10,13H,8-9,11-12H2,1-2H3,(H,24,27)