1-(4,6-dimethoxypyrimidin-2-yl)-3-[(2-ethanoyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(2-ethanoyl-3H-1,2-benzothiazol-7-yl)sulfonyl]urea Openeye Name: 1-[(2-acetyl-3H-1,2-benzothiazol-7-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-[(2-acetyl-3H-1,2-benzothiazol-7-yl)sulfonyl]-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-[(2-acetyl-3H-1,2-benzothiazol-7-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-[(2-acetyl-3H-1,2-benzothiazol-7-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C16H17N5O6S2 MolecularWeight: 439.46608

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC

Isomeric SMILES

CC(=O)N1CC2=C(S1)C(=CC=C2)S(=O)(=O)NC(=O)NC3=NC(=CC(=N3)OC)OC

InChI

InChI=1S/C16H17N5O6S2/c1-9(22)21-8-10-5-4-6-11(14(10)28-21)29(24,25)20-16(23)19-15-17-12(26-2)7-13(18-15)27-3/h4-7H,8H2,1-3H3,(H2,17,18,19,20,23)