2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-ethanamide

Systemtic Name: 2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-ethanamide Openeye Name: 2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butyl-acetamide CAS Name: 2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-[(4-bromophenyl)methyl]-2-pyrrolyl]methyl]-N-butylacetamide IUPAC Name: 2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-[(4-bromophenyl)methyl]pyrrol-2-yl]methyl]-N-butylacetamide Traditional Name: 2-[(4-acetamidophenyl)sulfonyl-(3-ethoxypropyl)amino]-N-[[1-(4-bromobenzyl)pyrrol-2-yl]methyl]-N-butyl-acetamide Formula: C31H41BrN4O5S MolecularWeight: 661.65004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(CCCOCC)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC=C(C=C2)Br)C(=O)CN(CCCOCC)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C31H41BrN4O5S/c1-4-6-18-35(23-29-9-7-19-34(29)22-26-10-12-27(32)13-11-26)31(38)24-36(20-8-21-41-5-2)42(39,40)30-16-14-28(15-17-30)33-25(3)37/h7,9-17,19H,4-6,8,18,20-24H2,1-3H3,(H,33,37)