2-[4-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol

Systemtic Name: 2-[4-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol Openeye Name: 2-[4-[[2-(o-tolyl)pyrimidin-5-yl]methyl]-1-(2-thienylmethyl)piperazin-2-yl]ethanol CAS Name: 2-[4-[[2-(2-methylphenyl)-5-pyrimidinyl]methyl]-1-(thiophen-2-ylmethyl)-2-piperazinyl]ethanol IUPAC Name: 2-[4-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]-1-(thiophen-2-ylmethyl)piperazin-2-yl]ethanol Traditional Name: 2-[4-[[2-(o-tolyl)pyrimidin-5-yl]methyl]-1-(2-thenyl)piperazin-2-yl]ethanol Formula: C23H28N4OS MolecularWeight: 408.55962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC=C(C=N2)CN3CCN(C(C3)CCO)CC4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1C2=NC=C(C=N2)CN3CCN(C(C3)CCO)CC4=CC=CS4

InChI

InChI=1S/C23H28N4OS/c1-18-5-2-3-7-22(18)23-24-13-19(14-25-23)15-26-9-10-27(20(16-26)8-11-28)17-21-6-4-12-29-21/h2-7,12-14,20,28H,8-11,15-17H2,1H3