methyl 4-(dimethylcarbamoyl)-3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 4-(dimethylcarbamoyl)-3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 4-(dimethylcarbamoyl)-3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 4-[dimethylamino(oxo)methyl]-3-[[[(4-methoxy-6-methyl-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-(dimethylcarbamoyl)-3-[(4-methoxy-6-methylpyrimidin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 4-(dimethylcarbamoyl)-3-[(4-methoxy-6-methyl-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C18H21N5O7S MolecularWeight: 451.45364

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N5O7S/c1-10-8-14(29-4)20-17(19-10)21-18(26)22-31(27,28)13-9-11(16(25)30-5)6-7-12(13)15(24)23(2)3/h6-9H,1-5H3,(H2,19,20,21,22,26)