ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]pyrrole-2-carboxylate

Systemtic Name: ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)sulfonyl-amino]ethanoyl]pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[isopentyl(p-tolylsulfonyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylate CAS Name: 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1,3,5-trimethyl-4-[2-[3-methylbutyl-(4-methylphenyl)sulfonylamino]acetyl]pyrrole-2-carboxylate Traditional Name: 4-[2-[isoamyl(tosyl)amino]acetyl]-1,3,5-trimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C24H34N2O5S MolecularWeight: 462.60216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H34N2O5S/c1-8-31-24(28)23-18(5)22(19(6)25(23)7)21(27)15-26(14-13-16(2)3)32(29,30)20-11-9-17(4)10-12-20/h9-12,16H,8,13-15H2,1-7H3