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

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-(2-dimethylaminoethyl)-3-oxidanylidene-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl]-N-(2-dimethylaminoethyl)-3-oxo-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-(2-dimethylaminoethyl)-3-oxo-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl]-N-(2-dimethylaminoethyl)-3-oxo-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2-chloro-6-fluoro-benzyl)-N-(2-dimethylaminoethyl)-3-keto-1,4-benzothiazine-6-carboxamide Formula: C20H21ClFN3O2S MolecularWeight: 421.916043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClFN3O2S/c1-24(2)9-8-23-20(27)13-6-7-18-17(10-13)25(19(26)12-28-18)11-14-15(21)4-3-5-16(14)22/h3-7,10H,8-9,11-12H2,1-2H3,(H,23,27)