methyl 2-[[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-(2-chlorophenyl)sulfamoyl]benzoate

Systemtic Name: methyl 2-[[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]-(2-chlorophenyl)sulfamoyl]benzoate Openeye Name: methyl 2-[(2-chlorophenyl)-[2-oxo-2-(sec-butylamino)ethyl]sulfamoyl]benzoate CAS Name: 2-[[2-(butan-2-ylamino)-2-oxoethyl]-(2-chlorophenyl)sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-(butan-2-ylamino)-2-oxoethyl]-(2-chlorophenyl)sulfamoyl]benzoate Traditional Name: 2-[(2-chlorophenyl)-[2-keto-2-(sec-butylamino)ethyl]sulfamoyl]benzoic acid methyl ester Formula: C20H23ClN2O5S MolecularWeight: 438.92502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CN(C1=CC=CC=C1Cl)S(=O)(=O)C2=CC=CC=C2C(=O)OC

Isomeric SMILES

CCC(C)NC(=O)CN(C1=CC=CC=C1Cl)S(=O)(=O)C2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C20H23ClN2O5S/c1-4-14(2)22-19(24)13-23(17-11-7-6-10-16(17)21)29(26,27)18-12-8-5-9-15(18)20(25)28-3/h5-12,14H,4,13H2,1-3H3,(H,22,24)