methyl 2-[(4-butyl-3,4-dihydropyrazol-2-yl)carbonylsulfamoyl]benzoate

Systemtic Name: methyl 2-[(4-butyl-3,4-dihydropyrazol-2-yl)carbonylsulfamoyl]benzoate Openeye Name: methyl 2-[(4-butyl-3,4-dihydropyrazole-2-carbonyl)sulfamoyl]benzoate CAS Name: 2-[[(4-butyl-3,4-dihydropyrazol-2-yl)-oxomethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(4-butyl-3,4-dihydropyrazole-2-carbonyl)sulfamoyl]benzoate Traditional Name: 2-[(4-butyl-2-pyrazoline-1-carbonyl)sulfamoyl]benzoic acid methyl ester Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(N=C1)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCCCC1CN(N=C1)C(=O)NS(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C16H21N3O5S/c1-3-4-7-12-10-17-19(11-12)16(21)18-25(22,23)14-9-6-5-8-13(14)15(20)24-2/h5-6,8-10,12H,3-4,7,11H2,1-2H3,(H,18,21)