N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]-4-pyrrolidinosulfonyl-benzamide Formula: C23H31N5O5S2 MolecularWeight: 521.65274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCCCS(=O)(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H31N5O5S2/c29-23(20-7-9-21(10-8-20)35(32,33)28-13-3-4-14-28)25-12-5-19-34(30,31)27-17-15-26(16-18-27)22-6-1-2-11-24-22/h1-2,6-11H,3-5,12-19H2,(H,25,29)