methyl 4-[2-[(4-acetamidophenyl)sulfonyl-propyl-amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-acetamidophenyl)sulfonyl-propyl-amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-acetamidophenyl)sulfonyl-propyl-amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-acetamidophenyl)sulfonyl-propylamino]-1-oxoethyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-acetamidophenyl)sulfonyl-propylamino]acetyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-acetamidophenyl)sulfonyl-propyl-amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C23H31N3O6S MolecularWeight: 477.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)C1=C(N(C(=C1C)C(=O)OC)CC)C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CCCN(CC(=O)C1=C(N(C(=C1C)C(=O)OC)CC)C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C23H31N3O6S/c1-7-13-25(33(30,31)19-11-9-18(10-12-19)24-17(5)27)14-20(28)21-15(3)22(23(29)32-6)26(8-2)16(21)4/h9-12H,7-8,13-14H2,1-6H3,(H,24,27)