methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-prop-2-enyl-carbamoyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-prop-2-enyl-carbamoyl]sulfamoyl]benzoate Openeye Name: methyl 2-[[allyl-(4,6-dimethylpyrimidin-2-yl)carbamoyl]sulfamoyl]benzoate CAS Name: 2-[[[(4,6-dimethyl-2-pyrimidinyl)-prop-2-enylamino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(4,6-dimethylpyrimidin-2-yl)-prop-2-enylcarbamoyl]sulfamoyl]benzoate Traditional Name: 2-[[allyl-(4,6-dimethylpyrimidin-2-yl)carbamoyl]sulfamoyl]benzoic acid methyl ester Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N(CC=C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)N(CC=C)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)C

InChI

InChI=1S/C18H20N4O5S/c1-5-10-22(17-19-12(2)11-13(3)20-17)18(24)21-28(25,26)15-9-7-6-8-14(15)16(23)27-4/h5-9,11H,1,10H2,2-4H3,(H,21,24)