3-[[4-[8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-[8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-[8-(3-thienyl)-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzonitrile CAS Name: 3-[[4-[8-(3-thiophenyl)-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[[4-[8-thiophen-3-yl-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-[8-(3-thienyl)-2-(trifluoromethyl)-1,6-naphthyridin-5-yl]piperazino]methyl]benzonitrile Formula: C25H20F3N5S MolecularWeight: 479.52001

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=NC=C(C4=C3C=CC(=N4)C(F)(F)F)C5=CSC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC(=C2)C#N)C3=NC=C(C4=C3C=CC(=N4)C(F)(F)F)C5=CSC=C5

InChI

InChI=1S/C25H20F3N5S/c26-25(27,28)22-5-4-20-23(31-22)21(19-6-11-34-16-19)14-30-24(20)33-9-7-32(8-10-33)15-18-3-1-2-17(12-18)13-29/h1-6,11-12,14,16H,7-10,15H2