[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2,5-dimethyl-1-[(4-sulfamoylphenyl)methyl]pyrrole-3-carboxylate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 2,5-dimethyl-1-[(4-sulfamoylphenyl)methyl]pyrrole-3-carboxylate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 2,5-dimethyl-1-[(4-sulfamoylphenyl)methyl]pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-[(4-sulfamoylphenyl)methyl]-3-pyrrolecarboxylic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 2,5-dimethyl-1-[(4-sulfamoylphenyl)methyl]pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(4-sulfamoylbenzyl)pyrrole-3-carboxylic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C21H27N3O5S MolecularWeight: 433.52118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)OCC(=O)NC3CCCC3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=C(C=C2)S(=O)(=O)N)C)C(=O)OCC(=O)NC3CCCC3

InChI

InChI=1S/C21H27N3O5S/c1-14-11-19(21(26)29-13-20(25)23-17-5-3-4-6-17)15(2)24(14)12-16-7-9-18(10-8-16)30(22,27)28/h7-11,17H,3-6,12-13H2,1-2H3,(H,23,25)(H2,22,27,28)