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

Systemtic Name: ethyl 2,5-dimethyl-4-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfamoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[[2-(benzylamino)-2-oxo-ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-4-[[2-oxo-2-[(phenylmethyl)amino]ethyl]sulfamoyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(benzylamino)-2-oxoethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[[2-(benzylamino)-2-keto-ethyl]sulfamoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NCC2=CC=CC=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1S(=O)(=O)NCC(=O)NCC2=CC=CC=C2)C)C

InChI

InChI=1S/C18H23N3O5S/c1-4-26-18(23)16-12(2)21-13(3)17(16)27(24,25)20-11-15(22)19-10-14-8-6-5-7-9-14/h5-9,20-21H,4,10-11H2,1-3H3,(H,19,22)