2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-methyl-N-(pyrimidin-4-ylmethyl)ethanamide

Systemtic Name: 2-[1-[(2-fluoranyl-4-methoxy-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-methyl-N-(pyrimidin-4-ylmethyl)ethanamide Openeye Name: 2-[1-[(2-fluoro-4-methoxy-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-methyl-N-(pyrimidin-4-ylmethyl)acetamide CAS Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxo-2-piperazinyl]-N-methyl-N-(4-pyrimidinylmethyl)acetamide IUPAC Name: 2-[1-[(2-fluoro-4-methoxyphenyl)methyl]-3-oxopiperazin-2-yl]-N-methyl-N-(pyrimidin-4-ylmethyl)acetamide Traditional Name: 2-[1-(2-fluoro-4-methoxy-benzyl)-3-keto-piperazin-2-yl]-N-methyl-N-(4-pyrimidylmethyl)acetamide Formula: C20H24FN5O3 MolecularWeight: 401.434663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC=NC=C1)C(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)OC)F

Isomeric SMILES

CN(CC1=NC=NC=C1)C(=O)CC2C(=O)NCCN2CC3=C(C=C(C=C3)OC)F

InChI

InChI=1S/C20H24FN5O3/c1-25(12-15-5-6-22-13-24-15)19(27)10-18-20(28)23-7-8-26(18)11-14-3-4-16(29-2)9-17(14)21/h3-6,9,13,18H,7-8,10-12H2,1-2H3,(H,23,28)