2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[4-[(3-bromophenyl)methyl]-1-piperazinyl]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[4-[(3-bromophenyl)methyl]piperazin-1-yl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[4-(3-bromobenzyl)piperazino]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C23H29BrN4O3S MolecularWeight: 521.47036

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCN(CC3)CC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CN3CCN(CC3)CC4=CC(=CC=C4)Br

InChI

InChI=1S/C23H29BrN4O3S/c24-20-5-3-4-19(16-20)17-26-12-14-27(15-13-26)18-23(29)25-21-6-8-22(9-7-21)32(30,31)28-10-1-2-11-28/h3-9,16H,1-2,10-15,17-18H2,(H,25,29)