1-(phenylmethyl)-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]phthalazine

Systemtic Name: 1-(phenylmethyl)-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]phthalazine Openeye Name: 1-benzyl-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]phthalazine CAS Name: 1-(phenylmethyl)-4-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]phthalazine IUPAC Name: 1-benzyl-4-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]phthalazine Traditional Name: 1-benzyl-4-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]phthalazine Formula: C25H22F3N5 MolecularWeight: 449.47089

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C25H22F3N5/c26-25(27,28)19-10-11-23(29-17-19)32-12-14-33(15-13-32)24-21-9-5-4-8-20(21)22(30-31-24)16-18-6-2-1-3-7-18/h1-11,17H,12-16H2