methyl 4-(acetamidomethyl)-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 4-(acetamidomethyl)-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 4-(acetamidomethyl)-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 4-(acetamidomethyl)-2-[[[(4,6-dimethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-(acetamidomethyl)-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 4-(acetamidomethyl)-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C18H21N5O8S MolecularWeight: 467.45304

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CC(=O)NCC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C18H21N5O8S/c1-10(24)19-9-11-5-6-12(16(25)31-4)13(7-11)32(27,28)23-18(26)22-17-20-14(29-2)8-15(21-17)30-3/h5-8H,9H2,1-4H3,(H,19,24)(H2,20,21,22,23,26)