2-[4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-1-phenyl-ethanol

Systemtic Name: 2-[4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-1-phenyl-ethanol Openeye Name: 2-[4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-1-phenyl-ethanol CAS Name: 2-[4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methyl-4-pyrimidinyl]-1-piperazinyl]-1-phenylethanol IUPAC Name: 2-[4-[5-[(4-chlorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl]piperazin-1-yl]-1-phenylethanol Traditional Name: 2-[4-[5-(4-chlorobenzyl)-6-ethyl-2-methyl-pyrimidin-4-yl]piperazino]-1-phenyl-ethanol Formula: C26H31ClN4O MolecularWeight: 451.00354

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(C3=CC=CC=C3)O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(C3=CC=CC=C3)O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H31ClN4O/c1-3-24-23(17-20-9-11-22(27)12-10-20)26(29-19(2)28-24)31-15-13-30(14-16-31)18-25(32)21-7-5-4-6-8-21/h4-12,25,32H,3,13-18H2,1-2H3