1-(4,6-dimethoxypyrimidin-2-yl)-3-[5-(1,2-oxazol-3-yl)-6-sulfanylidene-cyclohexa-1,3-dien-1-yl]sulfonyl-urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[5-(1,2-oxazol-3-yl)-6-sulfanylidene-cyclohexa-1,3-dien-1-yl]sulfonyl-urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(5-isoxazol-3-yl-6-thioxo-cyclohexa-1,3-dien-1-yl)sulfonyl-urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-[[5-(3-isoxazolyl)-6-sulfanylidene-1-cyclohexa-1,3-dienyl]sulfonyl]urea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[5-(1,2-oxazol-3-yl)-6-sulfanylidenecyclohexa-1,3-dien-1-yl]sulfonylurea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(5-isoxazol-3-yl-6-thioxo-cyclohexa-1,3-dien-1-yl)sulfonyl-urea Formula: C16H15N5O6S2 MolecularWeight: 437.4502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC(C2=S)C3=NOC=C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC(C2=S)C3=NOC=C3)OC

InChI

InChI=1S/C16H15N5O6S2/c1-25-12-8-13(26-2)18-15(17-12)19-16(22)21-29(23,24)11-5-3-4-9(14(11)28)10-6-7-27-20-10/h3-9H,1-2H3,(H2,17,18,19,21,22)