methyl 2-[[4-methyl-6-(oxan-2-yloxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate

Systemtic Name: methyl 2-[[4-methyl-6-(oxan-2-yloxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Openeye Name: methyl 2-[[4-methyl-6-(tetrahydropyran-2-yloxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate CAS Name: 2-[[[[4-methyl-6-(2-oxanyloxymethyl)-2-pyrimidinyl]amino]-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-methyl-6-(oxan-2-yloxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoate Traditional Name: 2-[[4-methyl-6-(tetrahydropyran-2-yloxymethyl)pyrimidin-2-yl]carbamoylsulfamoyl]benzoic acid methyl ester Formula: C20H24N4O7S MolecularWeight: 464.49216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)COC3CCCCO3

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC)COC3CCCCO3

InChI

InChI=1S/C20H24N4O7S/c1-13-11-14(12-31-17-9-5-6-10-30-17)22-19(21-13)23-20(26)24-32(27,28)16-8-4-3-7-15(16)18(25)29-2/h3-4,7-8,11,17H,5-6,9-10,12H2,1-2H3,(H2,21,22,23,24,26)