(3-piperidin-1-ylsulfonylphenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: (3-piperidin-1-ylsulfonylphenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Openeye Name: [3-(1-piperidylsulfonyl)phenyl]-[4-(2-thienylmethyl)piperazin-1-yl]methanone CAS Name: [3-(1-piperidinylsulfonyl)phenyl]-[4-(thiophen-2-ylmethyl)-1-piperazinyl]methanone IUPAC Name: (3-piperidin-1-ylsulfonylphenyl)-[4-(thiophen-2-ylmethyl)piperazin-1-yl]methanone Traditional Name: (3-piperidinosulfonylphenyl)-[4-(2-thenyl)piperazino]methanone Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C21H27N3O3S2/c25-21(23-13-11-22(12-14-23)17-19-7-5-15-28-19)18-6-4-8-20(16-18)29(26,27)24-9-2-1-3-10-24/h4-8,15-16H,1-3,9-14,17H2