5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2H-1,2,4-triazin-3-one

Systemtic Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2H-1,2,4-triazin-3-one Openeye Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2H-1,2,4-triazin-3-one CAS Name: 5-[4-[bis(4-fluorophenyl)methyl]-1-piperazinyl]-2H-1,2,4-triazin-3-one IUPAC Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazin-1-yl]-2H-1,2,4-triazin-3-one Traditional Name: 5-[4-[bis(4-fluorophenyl)methyl]piperazino]-2H-1,2,4-triazin-3-one Formula: C20H19F2N5O MolecularWeight: 383.394566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC(=O)NN=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1C2=NC(=O)NN=C2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C20H19F2N5O/c21-16-5-1-14(2-6-16)19(15-3-7-17(22)8-4-15)27-11-9-26(10-12-27)18-13-23-25-20(28)24-18/h1-8,13,19H,9-12H2,(H,24,25,28)