6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine

Systemtic Name: 6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine Openeye Name: N4-benzyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-N4-methyl-pyrimidine-4,5-diamine CAS Name: 6-[4-(4-fluorophenyl)-1-piperazinyl]-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5-diamine IUPAC Name: 4-N-benzyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-4-N-methylpyrimidine-4,5-diamine Traditional Name: [5-amino-6-[4-(4-fluorophenyl)piperazino]pyrimidin-4-yl]-benzyl-methyl-amine Formula: C22H25FN6 MolecularWeight: 392.472503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H25FN6/c1-27(15-17-5-3-2-4-6-17)21-20(24)22(26-16-25-21)29-13-11-28(12-14-29)19-9-7-18(23)8-10-19/h2-10,16H,11-15,24H2,1H3