[4-(phenylmethyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone

Systemtic Name: [4-(phenylmethyl)piperazin-1-yl]-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone Openeye Name: (4-benzylpiperazin-1-yl)-[1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: [4-(phenylmethyl)-1-piperazinyl]-(1-thiophen-2-ylsulfonyl-3-piperidinyl)methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(1-thiophen-2-ylsulfonylpiperidin-3-yl)methanone Traditional Name: (4-benzylpiperazino)-[1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C21H27N3O3S2/c25-21(23-13-11-22(12-14-23)16-18-6-2-1-3-7-18)19-8-4-10-24(17-19)29(26,27)20-9-5-15-28-20/h1-3,5-7,9,15,19H,4,8,10-14,16-17H2