1-(phenylmethyl)-4-(3-piperidin-1-ylsulfonylphenyl)sulfonyl-piperazine

Systemtic Name: 1-(phenylmethyl)-4-(3-piperidin-1-ylsulfonylphenyl)sulfonyl-piperazine Openeye Name: 1-benzyl-4-[3-(1-piperidylsulfonyl)phenyl]sulfonyl-piperazine CAS Name: 1-(phenylmethyl)-4-[3-(1-piperidinylsulfonyl)phenyl]sulfonylpiperazine IUPAC Name: 1-benzyl-4-(3-piperidin-1-ylsulfonylphenyl)sulfonylpiperazine Traditional Name: 1-benzyl-4-(3-piperidinosulfonylphenyl)sulfonyl-piperazine Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H29N3O4S2/c26-30(27,24-12-5-2-6-13-24)21-10-7-11-22(18-21)31(28,29)25-16-14-23(15-17-25)19-20-8-3-1-4-9-20/h1,3-4,7-11,18H,2,5-6,12-17,19H2