[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[phenyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[phenyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 3-[benzyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[phenyl-(phenylmethyl)sulfamoyl]benzoic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 3-[benzyl(phenyl)sulfamoyl]benzoate Traditional Name: 3-[benzyl(phenyl)sulfamoyl]benzoic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C27H29N3O6S MolecularWeight: 523.60066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C27H29N3O6S/c1-20(2)17-28-27(33)29-25(31)19-36-26(32)22-12-9-15-24(16-22)37(34,35)30(23-13-7-4-8-14-23)18-21-10-5-3-6-11-21/h3-16,20H,17-19H2,1-2H3,(H2,28,29,31,33)