4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Openeye Name: 4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide CAS Name: 4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methyl-4-pyrimidinyl]-N-(3-ethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-ethyl-5-[(3-fluorophenyl)methyl]-2-methylpyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Traditional Name: 4-[6-ethyl-5-(3-fluorobenzyl)-2-methyl-pyrimidin-4-yl]-N-(3-ethylphenyl)piperazine-1-carboxamide Formula: C27H32FN5O MolecularWeight: 461.574283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC(=CC=C4)F)CC)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC(=CC=C4)F)CC)C

InChI

InChI=1S/C27H32FN5O/c1-4-20-8-7-11-23(17-20)31-27(34)33-14-12-32(13-15-33)26-24(25(5-2)29-19(3)30-26)18-21-9-6-10-22(28)16-21/h6-11,16-17H,4-5,12-15,18H2,1-3H3,(H,31,34)