1-(4-bromanyl-6-methoxy-pyrimidin-2-yl)-3-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)urea

Systemtic Name: 1-(4-bromanyl-6-methoxy-pyrimidin-2-yl)-3-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)urea Openeye Name: 1-(4-bromo-6-methoxy-pyrimidin-2-yl)-3-(2,3-dihydrobenzothiophen-7-ylsulfonyl)urea CAS Name: 1-(4-bromo-6-methoxy-2-pyrimidinyl)-3-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)urea IUPAC Name: 1-(4-bromo-6-methoxypyrimidin-2-yl)-3-(2,3-dihydro-1-benzothiophen-7-ylsulfonyl)urea Traditional Name: 1-(4-bromo-6-methoxy-pyrimidin-2-yl)-3-(2,3-dihydrobenzothiophen-7-ylsulfonyl)urea Formula: C14H13BrN4O4S2 MolecularWeight: 445.31142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrN4O4S2/c1-23-11-7-10(15)16-13(17-11)18-14(20)19-25(21,22)9-4-2-3-8-5-6-24-12(8)9/h2-4,7H,5-6H2,1H3,(H2,16,17,18,19,20)