1-[4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]butan-2-ol

Systemtic Name: 1-[4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]butan-2-ol Openeye Name: 1-[4-[2,6-dimethyl-5-(m-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]butan-2-ol CAS Name: 1-[4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]-2-butanol IUPAC Name: 1-[4-[2,6-dimethyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]butan-2-ol Traditional Name: 1-[4-[2,6-dimethyl-5-(3-methylbenzyl)pyrimidin-4-yl]piperazino]butan-2-ol Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)C)C)O

Isomeric SMILES

CCC(CN1CCN(CC1)C2=NC(=NC(=C2CC3=CC=CC(=C3)C)C)C)O

InChI

InChI=1S/C22H32N4O/c1-5-20(27)15-25-9-11-26(12-10-25)22-21(17(3)23-18(4)24-22)14-19-8-6-7-16(2)13-19/h6-8,13,20,27H,5,9-12,14-15H2,1-4H3