1-[4-[6-methyl-5-[(3-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hex-5-en-2-ol

Systemtic Name: 1-[4-[6-methyl-5-[(3-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hex-5-en-2-ol Openeye Name: 1-[4-[6-methyl-5-(m-tolylmethyl)-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]hex-5-en-2-ol CAS Name: 1-[4-[6-methyl-5-[(3-methylphenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-5-hexen-2-ol IUPAC Name: 1-[4-[6-methyl-5-[(3-methylphenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]hex-5-en-2-ol Traditional Name: 1-[4-[6-methyl-5-(3-methylbenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]hex-5-en-2-ol Formula: C29H36N4O MolecularWeight: 456.62234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)CC(CCC=C)O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=CC=C1)CC2=C(N=C(N=C2N3CCN(CC3)CC(CCC=C)O)C4=CC=CC=C4)C

InChI

InChI=1S/C29H36N4O/c1-4-5-14-26(34)21-32-15-17-33(18-16-32)29-27(20-24-11-9-10-22(2)19-24)23(3)30-28(31-29)25-12-7-6-8-13-25/h4,6-13,19,26,34H,1,5,14-18,20-21H2,2-3H3