5-(4-chlorophenyl)-1-(piperidin-4-ylmethyl)-3-thiophen-2-ylsulfonyl-piperazin-2-one hydrochloride

Systemtic Name: 5-(4-chlorophenyl)-1-(piperidin-4-ylmethyl)-3-thiophen-2-ylsulfonyl-piperazin-2-one hydrochloride Openeye Name: 5-(4-chlorophenyl)-1-(4-piperidylmethyl)-3-(2-thienylsulfonyl)piperazin-2-one hydrochloride CAS Name: 5-(4-chlorophenyl)-1-(4-piperidinylmethyl)-3-thiophen-2-ylsulfonyl-2-piperazinone hydrochloride IUPAC Name: 5-(4-chlorophenyl)-1-(piperidin-4-ylmethyl)-3-thiophen-2-ylsulfonylpiperazin-2-one hydrochloride Traditional Name: 5-(4-chlorophenyl)-1-(4-piperidylmethyl)-3-(2-thienylsulfonyl)piperazin-2-one hydrochloride Formula: C20H25Cl2N3O3S2 MolecularWeight: 490.4668

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN2CC(NC(C2=O)S(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)Cl.Cl

Isomeric SMILES

C1CNCCC1CN2CC(NC(C2=O)S(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)Cl.Cl

InChI

InChI=1S/C20H24ClN3O3S2.ClH/c21-16-5-3-15(4-6-16)17-13-24(12-14-7-9-22-10-8-14)20(25)19(23-17)29(26,27)18-2-1-11-28-18;/h1-6,11,14,17,19,22-23H,7-10,12-13H2;1H