methyl 4-[2-[(4-bromophenyl)sulfonyl-(oxolan-2-ylmethyl)amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-(oxolan-2-ylmethyl)amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-(tetrahydrofuran-2-ylmethyl)amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-bromophenyl)sulfonyl-(2-oxolanylmethyl)amino]-1-oxoethyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-(oxolan-2-ylmethyl)amino]acetyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[brosyl(tetrahydrofurfuryl)amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C23H29BrN2O6S MolecularWeight: 541.45516

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CC2CCCO2)S(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OC)C)C(=O)CN(CC2CCCO2)S(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C23H29BrN2O6S/c1-5-26-16(3)21(15(2)22(26)23(28)31-4)20(27)14-25(13-18-7-6-12-32-18)33(29,30)19-10-8-17(24)9-11-19/h8-11,18H,5-7,12-14H2,1-4H3