1-[4-[6-ethyl-5-[(4-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: 1-[4-[6-ethyl-5-[(4-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: 1-[4-[6-ethyl-5-[(4-fluorophenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]-3-isopropoxy-propan-2-ol CAS Name: 1-[4-[6-ethyl-5-[(4-fluorophenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-3-propan-2-yloxy-2-propanol IUPAC Name: 1-[4-[6-ethyl-5-[(4-fluorophenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]-3-propan-2-yloxypropan-2-ol Traditional Name: 1-[4-[6-ethyl-5-(4-fluorobenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]-3-isopropoxy-propan-2-ol Formula: C29H37FN4O2 MolecularWeight: 492.628083

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)CC(COC(C)C)O)CC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)CC(COC(C)C)O)CC4=CC=C(C=C4)F

InChI

InChI=1S/C29H37FN4O2/c1-4-27-26(18-22-10-12-24(30)13-11-22)29(32-28(31-27)23-8-6-5-7-9-23)34-16-14-33(15-17-34)19-25(35)20-36-21(2)3/h5-13,21,25,35H,4,14-20H2,1-3H3