(2-bromophenyl)-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamic acid

Systemtic Name: (2-bromophenyl)-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamic acid Openeye Name: (2-bromophenyl)-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamic acid CAS Name: (2-bromophenyl)-[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamic acid IUPAC Name: (2-bromophenyl)-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamic acid Traditional Name: (2-bromophenyl)-[(4,6-dimethoxypyrimidin-2-yl)carbamoyl]sulfamic acid Formula: C13H13BrN4O6S MolecularWeight: 433.23452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)N(C2=CC=CC=C2Br)S(=O)(=O)O)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)N(C2=CC=CC=C2Br)S(=O)(=O)O)OC

InChI

InChI=1S/C13H13BrN4O6S/c1-23-10-7-11(24-2)16-12(15-10)17-13(19)18(25(20,21)22)9-6-4-3-5-8(9)14/h3-7H,1-2H3,(H,20,21,22)(H,15,16,17,19)