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

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-oxidanylidene-N-(pyridin-2-ylmethyl)-1,4-benzothiazine-6-carboxamide Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl]-3-oxo-N-(2-pyridylmethyl)-1,4-benzothiazine-6-carboxamide CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-N-(2-pyridinylmethyl)-1,4-benzothiazine-6-carboxamide IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl]-3-oxo-N-(pyridin-2-ylmethyl)-1,4-benzothiazine-6-carboxamide Traditional Name: 4-(2-chloro-6-fluoro-benzyl)-3-keto-N-(2-pyridylmethyl)-1,4-benzothiazine-6-carboxamide Formula: C22H17ClFN3O2S MolecularWeight: 441.905683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(S1)C=CC(=C2)C(=O)NCC3=CC=CC=N3)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1C(=O)N(C2=C(S1)C=CC(=C2)C(=O)NCC3=CC=CC=N3)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H17ClFN3O2S/c23-17-5-3-6-18(24)16(17)12-27-19-10-14(7-8-20(19)30-13-21(27)28)22(29)26-11-15-4-1-2-9-25-15/h1-10H,11-13H2,(H,26,29)