1-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)urea

Systemtic Name: 1-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)urea Openeye Name: 1-(2,3-dihydrobenzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)urea CAS Name: 1-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxy-2-pyrimidinyl)urea IUPAC Name: 1-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)urea Traditional Name: 1-(2,3-dihydrobenzothiophen-7-ylsulfonyl)-3-(4,6-dimethoxypyrimidin-2-yl)urea Formula: C15H16N4O5S2 MolecularWeight: 396.44134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC3=C2SCC3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC3=C2SCC3)OC

InChI

InChI=1S/C15H16N4O5S2/c1-23-11-8-12(24-2)17-14(16-11)18-15(20)19-26(21,22)10-5-3-4-9-6-7-25-13(9)10/h3-5,8H,6-7H2,1-2H3,(H2,16,17,18,19,20)