1-[2,6-dimethyl-4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]-2-(diphenylmethyl)sulfinyl-ethanone

Systemtic Name: 1-[2,6-dimethyl-4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]-2-(diphenylmethyl)sulfinyl-ethanone Openeye Name: 2-benzhydrylsulfinyl-1-[2,6-dimethyl-4-[(1-methyl-4-piperidyl)methyl]piperazin-1-yl]ethanone CAS Name: 1-[2,6-dimethyl-4-[(1-methyl-4-piperidinyl)methyl]-1-piperazinyl]-2-(diphenylmethyl)sulfinylethanone IUPAC Name: 2-benzhydrylsulfinyl-1-[2,6-dimethyl-4-[(1-methylpiperidin-4-yl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-benzhydrylsulfinyl-1-[2,6-dimethyl-4-[(1-methyl-4-piperidyl)methyl]piperazino]ethanone Formula: C28H39N3O2S MolecularWeight: 481.69316

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(N1C(=O)CS(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)CC4CCN(CC4)C

Isomeric SMILES

CC1CN(CC(N1C(=O)CS(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)C)CC4CCN(CC4)C

InChI

InChI=1S/C28H39N3O2S/c1-22-18-30(20-24-14-16-29(3)17-15-24)19-23(2)31(22)27(32)21-34(33)28(25-10-6-4-7-11-25)26-12-8-5-9-13-26/h4-13,22-24,28H,14-21H2,1-3H3