N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-cyclopropyl-N-[(2-fluorophenyl)methyl]-2-(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-cyclopropyl-N-(2-fluorobenzyl)-2-[4-(2-pyrimidyl)piperazin-1-ium-1-yl]acetamide Formula: C20H25FN5O+ MolecularWeight: 370.443803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CC1N(CC2=CC=CC=C2F)C(=O)C[NH+]3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C20H24FN5O/c21-18-5-2-1-4-16(18)14-26(17-6-7-17)19(27)15-24-10-12-25(13-11-24)20-22-8-3-9-23-20/h1-5,8-9,17H,6-7,10-15H2/p+1