1-[4-(diphenylmethyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone hydrochloride

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-1-yl]-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone hydrochloride Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone hydrochloride CAS Name: 1-[4-(diphenylmethyl)-1-piperazinyl]-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone hydrochloride IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone hydrochloride Traditional Name: 1-(4-benzhydrylpiperazino)-2-[4-(2-pyrimidyl)piperazino]ethanone hydrochloride Formula: C27H33ClN6O MolecularWeight: 493.04352

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CC=N5.Cl

Isomeric SMILES

C1CN(CCN1CC(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CC=N5.Cl

InChI

InChI=1S/C27H32N6O.ClH/c34-25(22-30-14-16-33(17-15-30)27-28-12-7-13-29-27)31-18-20-32(21-19-31)26(23-8-3-1-4-9-23)24-10-5-2-6-11-24;/h1-13,26H,14-22H2;1H