1-cyclobutyl-1-oxidanyl-1-phenyl-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-2-one dihydrochloride

Systemtic Name: 1-cyclobutyl-1-oxidanyl-1-phenyl-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-2-one dihydrochloride Openeye Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-(2-thienylmethyl)piperazin-1-yl]propan-2-one dihydrochloride CAS Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-(thiophen-2-ylmethyl)-1-piperazinyl]-2-propanone dihydrochloride IUPAC Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-(thiophen-2-ylmethyl)piperazin-1-yl]propan-2-one dihydrochloride Traditional Name: 1-cyclobutyl-1-hydroxy-1-phenyl-3-[4-(2-thenyl)piperazino]acetone dihydrochloride Formula: C22H30Cl2N2O2S MolecularWeight: 457.4568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC4=CC=CS4)O.Cl.Cl

Isomeric SMILES

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC4=CC=CS4)O.Cl.Cl

InChI

InChI=1S/C22H28N2O2S.2ClH/c25-21(22(26,19-8-4-9-19)18-6-2-1-3-7-18)17-24-13-11-23(12-14-24)16-20-10-5-15-27-20;;/h1-3,5-7,10,15,19,26H,4,8-9,11-14,16-17H2;2*1H