1-[4-[1-benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-propan-2-yl-piperazin-1-yl]-2-(1-ethanoylpiperidin-4-yl)ethanone

Systemtic Name: 1-[4-[1-benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-propan-2-yl-piperazin-1-yl]-2-(1-ethanoylpiperidin-4-yl)ethanone Openeye Name: 2-(1-acetyl-4-piperidyl)-1-[4-[benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-isopropyl-piperazin-1-yl]ethanone CAS Name: 2-(1-acetyl-4-piperidinyl)-1-[4-[1-benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-propan-2-yl-1-piperazinyl]ethanone IUPAC Name: 2-(1-acetylpiperidin-4-yl)-1-[4-[1-benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-propan-2-ylpiperazin-1-yl]ethanone Traditional Name: 2-(1-acetyl-4-piperidyl)-1-[4-[benzothiophen-2-yl-(4-chlorophenyl)methyl]-2-isopropyl-piperazino]ethanone Formula: C31H38ClN3O2S MolecularWeight: 552.17032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)C)C(C3=CC=C(C=C3)Cl)C4=CC5=CC=CC=C5S4

Isomeric SMILES

CC(C)C1CN(CCN1C(=O)CC2CCN(CC2)C(=O)C)C(C3=CC=C(C=C3)Cl)C4=CC5=CC=CC=C5S4

InChI

InChI=1S/C31H38ClN3O2S/c1-21(2)27-20-34(16-17-35(27)30(37)18-23-12-14-33(15-13-23)22(3)36)31(24-8-10-26(32)11-9-24)29-19-25-6-4-5-7-28(25)38-29/h4-11,19,21,23,27,31H,12-18,20H2,1-3H3