2-[(2-bromophenyl)methyl-methyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2-bromophenyl)methyl-methyl-amino]-N-(4-piperidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(2-bromophenyl)methyl-methyl-amino]-N-[4-(1-piperidylsulfonyl)phenyl]acetamide CAS Name: 2-[(2-bromophenyl)methyl-methylamino]-N-[4-(1-piperidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(2-bromophenyl)methyl-methylamino]-N-(4-piperidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(2-bromobenzyl)-methyl-amino]-N-(4-piperidinosulfonylphenyl)acetamide Formula: C21H26BrN3O3S MolecularWeight: 480.41844

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1Br)CC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H26BrN3O3S/c1-24(15-17-7-3-4-8-20(17)22)16-21(26)23-18-9-11-19(12-10-18)29(27,28)25-13-5-2-6-14-25/h3-4,7-12H,2,5-6,13-16H2,1H3,(H,23,26)