ethyl 2,5-dimethyl-4-[[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,5-dimethyl-4-[[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,5-dimethyl-4-[[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]sulfamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,5-dimethyl-4-[[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-[[2-keto-2-(4-phenylpiperazino)ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)N2CCN(CC2)C3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)N2CCN(CC2)C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H28N4O5S/c1-4-30-21(27)19-15(2)23-16(3)20(19)31(28,29)22-14-18(26)25-12-10-24(11-13-25)17-8-6-5-7-9-17/h5-9,22-23H,4,10-14H2,1-3H3