2-(isoquinolin-7-ylamino)-N-(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)pyridine-3-carboxamide

Systemtic Name: 2-(isoquinolin-7-ylamino)-N-(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)pyridine-3-carboxamide Openeye Name: 2-(7-isoquinolylamino)-N-(3-oxo-4H-1,4-benzothiazin-6-yl)pyridine-3-carboxamide CAS Name: 2-(7-isoquinolinylamino)-N-(3-oxo-4H-1,4-benzothiazin-6-yl)-3-pyridinecarboxamide IUPAC Name: 2-(isoquinolin-7-ylamino)-N-(3-oxo-4H-1,4-benzothiazin-6-yl)pyridine-3-carboxamide Traditional Name: 2-(7-isoquinolylamino)-N-(3-keto-4H-1,4-benzothiazin-6-yl)nicotinamide Formula: C23H17N5O2S MolecularWeight: 427.47838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5

InChI

InChI=1S/C23H17N5O2S/c29-21-13-31-20-6-5-17(11-19(20)28-21)27-23(30)18-2-1-8-25-22(18)26-16-4-3-14-7-9-24-12-15(14)10-16/h1-12H,13H2,(H,25,26)(H,27,30)(H,28,29)