1-(4-phenylpiperazin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-phenylpiperazin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-phenylpiperazin-1-yl)-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(4-phenyl-1-piperazinyl)-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(4-phenylpiperazin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(4-phenylpiperazino)-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C21H19F3N4OS2 MolecularWeight: 464.52697

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CSC3=NC(=CC(=N3)C(F)(F)F)C4=CC=CS4

InChI

InChI=1S/C21H19F3N4OS2/c22-21(23,24)18-13-16(17-7-4-12-30-17)25-20(26-18)31-14-19(29)28-10-8-27(9-11-28)15-5-2-1-3-6-15/h1-7,12-13H,8-11,14H2