ethyl 4-[(4-ethylsulfonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[(4-ethylsulfonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[(4-ethylsulfonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(4-ethylsulfonylanilino)-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethylsulfonylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(4-esylphenyl)carbamoyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)CC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)CC)C

InChI

InChI=1S/C18H22N2O5S/c1-5-25-18(22)16-11(3)15(12(4)19-16)17(21)20-13-7-9-14(10-8-13)26(23,24)6-2/h7-10,19H,5-6H2,1-4H3,(H,20,21)