2-[6-(furan-2-ylcarbonylamino)pyridazin-3-yl]sulfanylethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[6-(furan-2-ylcarbonylamino)pyridazin-3-yl]sulfanylethyl-di(propan-2-yl)azanium Openeye Name: 2-[6-(furan-2-carbonylamino)pyridazin-3-yl]sulfanylethyl-diisopropyl-ammonium CAS Name: 2-[[6-[[2-furanyl(oxo)methyl]amino]-3-pyridazinyl]thio]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[6-(furan-2-carbonylamino)pyridazin-3-yl]sulfanylethyl-di(propan-2-yl)azanium Traditional Name: 2-[[6-(2-furoylamino)pyridazin-3-yl]thio]ethyl-diisopropyl-ammonium Formula: C17H25N4O2S+ MolecularWeight: 349.471

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCSC1=NN=C(C=C1)NC(=O)C2=CC=CO2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCSC1=NN=C(C=C1)NC(=O)C2=CC=CO2)C(C)C

InChI

InChI=1S/C17H24N4O2S/c1-12(2)21(13(3)4)9-11-24-16-8-7-15(19-20-16)18-17(22)14-6-5-10-23-14/h5-8,10,12-13H,9,11H2,1-4H3,(H,18,19,22)/p+1