[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoate CAS Name: 3-[ethyl(phenyl)sulfamoyl]-4-methylbenzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 3-[ethyl(phenyl)sulfamoyl]-4-methylbenzoate Traditional Name: 3-[ethyl(phenyl)sulfamoyl]-4-methyl-benzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NCCC(C)C)C

Isomeric SMILES

CCN(C1=CC=CC=C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)NCCC(C)C)C

InChI

InChI=1S/C23H30N2O5S/c1-5-25(20-9-7-6-8-10-20)31(28,29)21-15-19(12-11-18(21)4)23(27)30-16-22(26)24-14-13-17(2)3/h6-12,15,17H,5,13-14,16H2,1-4H3,(H,24,26)