[4-[6-(3-oxidanylprop-1-ynyl)pyridazin-3-yl]-2-(trifluoromethyl)phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-[6-(3-oxidanylprop-1-ynyl)pyridazin-3-yl]-2-(trifluoromethyl)phenyl]-piperazin-1-yl-methanone Openeye Name: [4-[6-(3-hydroxyprop-1-ynyl)pyridazin-3-yl]-2-(trifluoromethyl)phenyl]-piperazin-1-yl-methanone CAS Name: [4-[6-(3-hydroxyprop-1-ynyl)-3-pyridazinyl]-2-(trifluoromethyl)phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-[6-(3-hydroxyprop-1-ynyl)pyridazin-3-yl]-2-(trifluoromethyl)phenyl]-piperazin-1-ylmethanone Traditional Name: [4-[6-(3-hydroxyprop-1-ynyl)pyridazin-3-yl]-2-(trifluoromethyl)phenyl]-piperazino-methanone Formula: C19H17F3N4O2 MolecularWeight: 390.35909

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)C2=C(C=C(C=C2)C3=NN=C(C=C3)C#CCO)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C(=O)C2=C(C=C(C=C2)C3=NN=C(C=C3)C#CCO)C(F)(F)F

InChI

InChI=1S/C19H17F3N4O2/c20-19(21,22)16-12-13(17-6-4-14(24-25-17)2-1-11-27)3-5-15(16)18(28)26-9-7-23-8-10-26/h3-6,12,23,27H,7-11H2