3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine

Systemtic Name: 3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]-N-(phenylmethyl)pyridin-2-amine Openeye Name: N-benzyl-3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine CAS Name: 3-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]methyl]-N-(phenylmethyl)-2-pyridinamine IUPAC Name: N-benzyl-3-[[4-(3-bromophenyl)sulfonylpiperazin-1-yl]methyl]pyridin-2-amine Traditional Name: benzyl-[3-[[4-(3-bromophenyl)sulfonylpiperazino]methyl]-2-pyridyl]amine Formula: C23H25BrN4O2S MolecularWeight: 501.4392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(N=CC=C2)NCC3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=C(N=CC=C2)NCC3=CC=CC=C3)S(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C23H25BrN4O2S/c24-21-9-4-10-22(16-21)31(29,30)28-14-12-27(13-15-28)18-20-8-5-11-25-23(20)26-17-19-6-2-1-3-7-19/h1-11,16H,12-15,17-18H2,(H,25,26)