N-(6-methoxypyrimidin-4-yl)-4-(3-oxidanylidene-1,2-benzothiazol-2-yl)benzenesulfonamide

Systemtic Name: N-(6-methoxypyrimidin-4-yl)-4-(3-oxidanylidene-1,2-benzothiazol-2-yl)benzenesulfonamide Openeye Name: N-(6-methoxypyrimidin-4-yl)-4-(3-oxo-1,2-benzothiazol-2-yl)benzenesulfonamide CAS Name: N-(6-methoxy-4-pyrimidinyl)-4-(3-oxo-1,2-benzothiazol-2-yl)benzenesulfonamide IUPAC Name: N-(6-methoxypyrimidin-4-yl)-4-(3-oxo-1,2-benzothiazol-2-yl)benzenesulfonamide Traditional Name: 4-(3-keto-1,2-benzothiazol-2-yl)-N-(6-methoxypyrimidin-4-yl)benzenesulfonamide Formula: C18H14N4O4S2 MolecularWeight: 414.45816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4S3

Isomeric SMILES

COC1=NC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4S3

InChI

InChI=1S/C18H14N4O4S2/c1-26-17-10-16(19-11-20-17)21-28(24,25)13-8-6-12(7-9-13)22-18(23)14-4-2-3-5-15(14)27-22/h2-11H,1H3,(H,19,20,21)