methyl 2-[[4-methoxy-6-(phenoxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-methoxy-6-(phenoxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-methoxy-6-(phenoxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-methoxy-6-(phenoxymethyl)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-methoxy-6-(phenoxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-methoxy-6-(phenoxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C21H20N4O7S MolecularWeight: 472.4711

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)COC2=CC=CC=C2)NC(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=NC(=NC(=C1)COC2=CC=CC=C2)NC(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H20N4O7S/c1-30-18-12-14(13-32-15-8-4-3-5-9-15)22-20(23-18)24-21(27)25-33(28,29)17-11-7-6-10-16(17)19(26)31-2/h3-12H,13H2,1-2H3,(H2,22,23,24,25,27)