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

Systemtic Name: 1-[4-[5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-propan-2-ol Openeye Name: 1-[4-[5-[(2-chloro-6-fluoro-phenyl)methyl]-6-ethyl-2-methyl-pyrimidin-4-yl]piperazin-1-yl]-3-phenyl-propan-2-ol CAS Name: 1-[4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-methyl-4-pyrimidinyl]-1-piperazinyl]-3-phenyl-2-propanol IUPAC Name: 1-[4-[5-[(2-chloro-6-fluorophenyl)methyl]-6-ethyl-2-methylpyrimidin-4-yl]piperazin-1-yl]-3-phenylpropan-2-ol Traditional Name: 1-[4-[5-(2-chloro-6-fluoro-benzyl)-6-ethyl-2-methyl-pyrimidin-4-yl]piperazino]-3-phenyl-propan-2-ol Formula: C27H32ClFN4O MolecularWeight: 483.020583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(CC3=CC=CC=C3)O)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(CC3=CC=CC=C3)O)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C27H32ClFN4O/c1-3-26-23(17-22-24(28)10-7-11-25(22)29)27(31-19(2)30-26)33-14-12-32(13-15-33)18-21(34)16-20-8-5-4-6-9-20/h4-11,21,34H,3,12-18H2,1-2H3