5,7-bis(fluoranyl)-N-[2-(6-methoxyquinolin-4-yl)-4,5,6,7-tetrahydroindazol-5-yl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide

Systemtic Name: 5,7-bis(fluoranyl)-N-[2-(6-methoxyquinolin-4-yl)-4,5,6,7-tetrahydroindazol-5-yl]-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide Openeye Name: 5,7-difluoro-N-[2-(6-methoxy-4-quinolyl)-4,5,6,7-tetrahydroindazol-5-yl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide CAS Name: 5,7-difluoro-N-[2-(6-methoxy-4-quinolinyl)-4,5,6,7-tetrahydroindazol-5-yl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide IUPAC Name: 5,7-difluoro-N-[2-(6-methoxyquinolin-4-yl)-4,5,6,7-tetrahydroindazol-5-yl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide Traditional Name: 5,7-difluoro-3-keto-N-[2-(6-methoxy-4-quinolyl)-4,5,6,7-tetrahydroindazol-5-yl]-4H-1,4-benzothiazine-6-carboxamide Formula: C26H21F2N5O3S MolecularWeight: 521.538446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)N3C=C4CC(CCC4=N3)NC(=O)C5=C(C6=C(C=C5F)SCC(=O)N6)F

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)N3C=C4CC(CCC4=N3)NC(=O)C5=C(C6=C(C=C5F)SCC(=O)N6)F

InChI

InChI=1S/C26H21F2N5O3S/c1-36-15-3-5-19-16(9-15)20(6-7-29-19)33-11-13-8-14(2-4-18(13)32-33)30-26(35)23-17(27)10-21-25(24(23)28)31-22(34)12-37-21/h3,5-7,9-11,14H,2,4,8,12H2,1H3,(H,30,35)(H,31,34)