methyl 2-aminocarbonyl-3-(4,6-dimethoxypyrimidin-2-yl)-4-(methylsulfonylaminomethyl)-6-sulfamoyl-benzoate

Systemtic Name: methyl 2-aminocarbonyl-3-(4,6-dimethoxypyrimidin-2-yl)-4-(methylsulfonylaminomethyl)-6-sulfamoyl-benzoate Openeye Name: methyl 2-carbamoyl-3-(4,6-dimethoxypyrimidin-2-yl)-4-(methanesulfonamidomethyl)-6-sulfamoyl-benzoate CAS Name: 2-carbamoyl-3-(4,6-dimethoxy-2-pyrimidinyl)-4-(methanesulfonamidomethyl)-6-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 2-carbamoyl-3-(4,6-dimethoxypyrimidin-2-yl)-4-(methanesulfonamidomethyl)-6-sulfamoylbenzoate Traditional Name: 2-carbamoyl-3-(4,6-dimethoxypyrimidin-2-yl)-4-(methanesulfonamidomethyl)-6-sulfamoyl-benzoic acid methyl ester Formula: C17H21N5O9S2 MolecularWeight: 503.50674

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)C2=C(C(=C(C=C2CNS(=O)(=O)C)S(=O)(=O)N)C(=O)OC)C(=O)N)OC

Isomeric SMILES

COC1=CC(=NC(=N1)C2=C(C(=C(C=C2CNS(=O)(=O)C)S(=O)(=O)N)C(=O)OC)C(=O)N)OC

InChI

InChI=1S/C17H21N5O9S2/c1-29-10-6-11(30-2)22-16(21-10)12-8(7-20-32(4,25)26)5-9(33(19,27)28)13(17(24)31-3)14(12)15(18)23/h5-6,20H,7H2,1-4H3,(H2,18,23)(H2,19,27,28)