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

Systemtic Name: 7-(3-methylbutyl)-5-[7-oxidanyl-1,1-bis(oxidanylidene)-4H-1$l^{6},2,4-benzothiadiazin-3-yl]thieno[2,3-b]pyridine-4,6-dione Openeye Name: 5-(7-hydroxy-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-isopentyl-thieno[2,3-b]pyridine-4,6-dione CAS Name: 5-(7-hydroxy-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione IUPAC Name: 5-(7-hydroxy-1,1-dioxo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-(3-methylbutyl)thieno[2,3-b]pyridine-4,6-dione Traditional Name: 5-(7-hydroxy-1,1-diketo-4H-1$l^{6},2,4-benzothiadiazin-3-yl)-7-isoamyl-thieno[2,3-b]pyridine-4,6-quinone Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C(C(=O)C2=C1SC=C2)C3=NS(=O)(=O)C4=C(N3)C=CC(=C4)O

Isomeric SMILES

CC(C)CCN1C(=O)C(C(=O)C2=C1SC=C2)C3=NS(=O)(=O)C4=C(N3)C=CC(=C4)O

InChI

InChI=1S/C19H19N3O5S2/c1-10(2)5-7-22-18(25)15(16(24)12-6-8-28-19(12)22)17-20-13-4-3-11(23)9-14(13)29(26,27)21-17/h3-4,6,8-10,15,23H,5,7H2,1-2H3,(H,20,21)