2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]pyrimidine-5-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]pyrimidine-5-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]pyrimidine-5-carboxamide CAS Name: 2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methyl-1-piperazinyl]methyl]phenyl]-5-pyrimidinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazin-1-yl]methyl]phenyl]pyrimidine-5-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-methyl-N-[4-[[(3S)-3-methylpiperazino]methyl]phenyl]pyrimidine-5-carboxamide Formula: C24H26FN5O MolecularWeight: 419.494543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CN=C(N=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=C(C=C2)N(C)C(=O)C3=CN=C(N=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H26FN5O/c1-17-15-30(12-11-26-17)16-18-3-9-22(10-4-18)29(2)24(31)20-13-27-23(28-14-20)19-5-7-21(25)8-6-19/h3-10,13-14,17,26H,11-12,15-16H2,1-2H3/t17-/m0/s1