ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-propan-2-yl-amino]ethanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-propan-2-yl-amino]ethanoyl]-1,3,5-trimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-isopropyl-amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-acetamidophenyl)sulfonyl-propan-2-ylamino]-1-oxoethyl]-1,3,5-trimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-acetamidophenyl)sulfonyl-propan-2-ylamino]acetyl]-1,3,5-trimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[(4-acetamidophenyl)sulfonyl-isopropyl-amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C23H31N3O6S MolecularWeight: 477.57374

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1C)C)C(=O)CN(C(C)C)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C)C

InChI

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