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

Systemtic Name: 1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-3-(2-methylpropoxy)propan-2-ol Openeye Name: 1-[4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]-3-isobutoxy-propan-2-ol CAS Name: 1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]-3-(2-methylpropoxy)-2-propanol IUPAC Name: 1-[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-3-(2-methylpropoxy)propan-2-ol Traditional Name: 1-[4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]piperazino]-3-isobutoxy-propan-2-ol Formula: C26H40N4O2 MolecularWeight: 440.6214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(COCC(C)C)O)CC3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(COCC(C)C)O)CC3=CC=C(C=C3)C

InChI

InChI=1S/C26H40N4O2/c1-6-25-24(15-22-9-7-20(4)8-10-22)26(28-21(5)27-25)30-13-11-29(12-14-30)16-23(31)18-32-17-19(2)3/h7-10,19,23,31H,6,11-18H2,1-5H3