5-[1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione

Systemtic Name: 5-[1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione Openeye Name: 5-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-isopentyl-thieno[2,3-b]pyridine-4,6-dione CAS Name: 5-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione IUPAC Name: 5-(1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione Traditional Name: 5-(1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-isoamyl-thieno[2,3-b]pyridine-4,6-quinone Formula: C19H19N3O4S2 MolecularWeight: 417.50186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C(C(=O)C2=C1SC=C2)C3=NS(=O)(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC(C)CCN1C(=O)C(C(=O)C2=C1SC=C2)C3=NS(=O)(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C19H19N3O4S2/c1-11(2)7-9-22-18(24)15(16(23)12-8-10-27-19(12)22)17-20-13-5-3-4-6-14(13)28(25,26)21-17/h3-6,8,10-11,15H,7,9H2,1-2H3,(H,20,21)