methyl 2-[(4-cyclopropyl-6-ethoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[(4-cyclopropyl-6-ethoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[(4-cyclopropyl-6-ethoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoate CAS Name: 2-[[[(4-cyclopropyl-6-ethoxy-2-pyrimidinyl)amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-cyclopropyl-6-ethoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate Traditional Name: 2-[(4-cyclopropyl-6-ethoxy-pyrimidin-2-yl)carbamoylsulfamoyl]benzoic acid methyl ester Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1)C2CC2)NC(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCOC1=NC(=NC(=C1)C2CC2)NC(=O)NS(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C18H20N4O6S/c1-3-28-15-10-13(11-8-9-11)19-17(20-15)21-18(24)22-29(25,26)14-7-5-4-6-12(14)16(23)27-2/h4-7,10-11H,3,8-9H2,1-2H3,(H2,19,20,21,22,24)