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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)CC)C)C(=O)OC

Isomeric SMILES

CCC1=C(C(=C(N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)CC)C)C(=O)OC

InChI

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