3-[4-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperazin-1-yl]sulfonyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-[1-[(2-azanylpyridin-4-yl)methyl]piperidin-4-yl]carbonylpiperazin-1-yl]sulfonyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-[1-[(2-amino-4-pyridyl)methyl]piperidine-4-carbonyl]piperazin-1-yl]sulfonyl-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[4-[[1-[(2-amino-4-pyridinyl)methyl]-4-piperidinyl]-oxomethyl]-1-piperazinyl]sulfonyl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-[1-[(2-aminopyridin-4-yl)methyl]piperidine-4-carbonyl]piperazin-1-yl]sulfonyl-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[4-[1-[(2-amino-4-pyridyl)methyl]isonipecotoyl]piperazino]sulfonyl-N,N-dimethyl-benzenesulfonamide Formula: C24H34N6O5S2 MolecularWeight: 550.69396

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=CC(=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)CC4=CC(=NC=C4)N

InChI

InChI=1S/C24H34N6O5S2/c1-27(2)36(32,33)21-4-3-5-22(17-21)37(34,35)30-14-12-29(13-15-30)24(31)20-7-10-28(11-8-20)18-19-6-9-26-23(25)16-19/h3-6,9,16-17,20H,7-8,10-15,18H2,1-2H3,(H2,25,26)