1-[(6,7-dimethoxy-3-oxidanylidene-4H-1,4-benzoxazin-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-[(6,7-dimethoxy-3-oxidanylidene-4H-1,4-benzoxazin-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-[(6,7-dimethoxy-3-oxo-4H-1,4-benzoxazin-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-[(6,7-dimethoxy-3-oxo-4H-1,4-benzoxazin-8-yl)sulfonyl]-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-[(6,7-dimethoxy-3-oxo-4H-1,4-benzoxazin-8-yl)sulfonyl]-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[(3-keto-6,7-dimethoxy-4H-1,4-benzoxazin-8-yl)sulfonyl]urea Formula: C17H19N5O9S MolecularWeight: 469.42586

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C3C(=CC(=C2OC)OC)NC(=O)CO3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C3C(=CC(=C2OC)OC)NC(=O)CO3)OC

InChI

InChI=1S/C17H19N5O9S/c1-27-9-5-8-13(31-7-10(23)18-8)15(14(9)30-4)32(25,26)22-17(24)21-16-19-11(28-2)6-12(20-16)29-3/h5-6H,7H2,1-4H3,(H,18,23)(H2,19,20,21,22,24)