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

Systemtic Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-propyl-amino]ethanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-propyl-amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[(4-bromophenyl)sulfonyl-propylamino]-1-oxoethyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-[(4-bromophenyl)sulfonyl-propylamino]acetyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[brosyl(propyl)amino]acetyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid methyl ester Formula: C21H27BrN2O5S MolecularWeight: 499.41848

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C21H27BrN2O5S/c1-6-12-23(30(27,28)17-10-8-16(22)9-11-17)13-18(25)19-14(3)20(21(26)29-5)24(7-2)15(19)4/h8-11H,6-7,12-13H2,1-5H3