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

Systemtic Name: [4-(phenylcarbonyl)piperazin-1-yl]-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Openeye Name: (4-benzoylpiperazin-1-yl)-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone CAS Name: (4-benzoyl-1-piperazinyl)-[(3S)-1-thiophen-2-ylsulfonyl-3-piperidinyl]methanone IUPAC Name: (4-benzoylpiperazin-1-yl)-[(3S)-1-thiophen-2-ylsulfonylpiperidin-3-yl]methanone Traditional Name: (4-benzoylpiperazino)-[(3S)-1-(2-thienylsulfonyl)-3-piperidyl]methanone Formula: C21H25N3O4S2 MolecularWeight: 447.5709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O4S2/c25-20(17-6-2-1-3-7-17)22-11-13-23(14-12-22)21(26)18-8-4-10-24(16-18)30(27,28)19-9-5-15-29-19/h1-3,5-7,9,15,18H,4,8,10-14,16H2/t18-/m0/s1