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

Systemtic Name: N-ethyl-4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-ethyl-4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-ethyl-4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-methyl-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-ethyl-4-[6-ethyl-5-[(2-fluorophenyl)methyl]-2-methylpyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-ethyl-4-[6-ethyl-5-(2-fluorobenzyl)-2-methyl-pyrimidin-4-yl]piperazine-1-carboxamide Formula: C21H28FN5O MolecularWeight: 385.478323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NCC)CC3=CC=CC=C3F

Isomeric SMILES

CCC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)NCC)CC3=CC=CC=C3F

InChI

InChI=1S/C21H28FN5O/c1-4-19-17(14-16-8-6-7-9-18(16)22)20(25-15(3)24-19)26-10-12-27(13-11-26)21(28)23-5-2/h6-9H,4-5,10-14H2,1-3H3,(H,23,28)