2-[(5-bromanyl-4-methoxy-6-methyl-pyrimidin-2-yl)-(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[(5-bromanyl-4-methoxy-6-methyl-pyrimidin-2-yl)-(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[benzenesulfonyl-(5-bromo-4-methoxy-6-methyl-pyrimidin-2-yl)amino]acetic acid CAS Name: 2-[benzenesulfonyl-(5-bromo-4-methoxy-6-methyl-2-pyrimidinyl)amino]acetic acid IUPAC Name: 2-[benzenesulfonyl-(5-bromo-4-methoxy-6-methylpyrimidin-2-yl)amino]acetic acid Traditional Name: 2-[besyl-(5-bromo-4-methoxy-6-methyl-pyrimidin-2-yl)amino]acetic acid Formula: C14H14BrN3O5S MolecularWeight: 416.24706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)N(CC(=O)O)S(=O)(=O)C2=CC=CC=C2)OC)Br

Isomeric SMILES

CC1=C(C(=NC(=N1)N(CC(=O)O)S(=O)(=O)C2=CC=CC=C2)OC)Br

InChI

InChI=1S/C14H14BrN3O5S/c1-9-12(15)13(23-2)17-14(16-9)18(8-11(19)20)24(21,22)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3,(H,19,20)