1-[4-(phenylmethyl)piperazin-1-yl]-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone

Systemtic Name: 1-[4-(phenylmethyl)piperazin-1-yl]-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Openeye Name: 1-(4-benzylpiperazin-1-yl)-2-[5-(1-piperidylsulfonyl)-2-thienyl]ethanone CAS Name: 1-[4-(phenylmethyl)-1-piperazinyl]-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]ethanone IUPAC Name: 1-(4-benzylpiperazin-1-yl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Traditional Name: 1-(4-benzylpiperazino)-2-(5-piperidinosulfonyl-2-thienyl)ethanone Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H29N3O3S2/c26-21(24-15-13-23(14-16-24)18-19-7-3-1-4-8-19)17-20-9-10-22(29-20)30(27,28)25-11-5-2-6-12-25/h1,3-4,7-10H,2,5-6,11-18H2