1-[4-[6-ethyl-2-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[4-[6-ethyl-2-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-3-phenoxy-propan-2-ol Openeye Name: 1-[4-[6-ethyl-2-methyl-5-(m-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]-3-phenoxy-propan-2-ol CAS Name: 1-[4-[6-ethyl-2-methyl-5-[(3-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]-3-phenoxy-2-propanol IUPAC Name: 1-[4-[6-ethyl-2-methyl-5-[(3-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-3-phenoxypropan-2-ol Traditional Name: 1-[4-[6-ethyl-2-methyl-5-(3-methylbenzyl)pyrimidin-4-yl]piperazino]-3-phenoxy-propan-2-ol Formula: C28H36N4O2 MolecularWeight: 460.61104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(COC3=CC=CC=C3)O)CC4=CC=CC(=C4)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(COC3=CC=CC=C3)O)CC4=CC=CC(=C4)C

InChI

InChI=1S/C28H36N4O2/c1-4-27-26(18-23-10-8-9-21(2)17-23)28(30-22(3)29-27)32-15-13-31(14-16-32)19-24(33)20-34-25-11-6-5-7-12-25/h5-12,17,24,33H,4,13-16,18-20H2,1-3H3