N-(6-methyl-1,3-benzothiazol-2-yl)-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide

Systemtic Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2,4-bis(oxidanylidene)-1H-pyrimidine-5-sulfonamide Openeye Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide CAS Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide IUPAC Name: N-(6-methyl-1,3-benzothiazol-2-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide Traditional Name: 2,4-diketo-N-(6-methyl-1,3-benzothiazol-2-yl)-1H-pyrimidine-5-sulfonamide Formula: C12H10N4O4S2 MolecularWeight: 338.3622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CNC(=O)NC3=O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NS(=O)(=O)C3=CNC(=O)NC3=O

InChI

InChI=1S/C12H10N4O4S2/c1-6-2-3-7-8(4-6)21-12(14-7)16-22(19,20)9-5-13-11(18)15-10(9)17/h2-5H,1H3,(H,14,16)(H2,13,15,17,18)