5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Openeye Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-methyl-isoxazole CAS Name: 5-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]-3-methylisoxazole IUPAC Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-methyl-1,2-oxazole Traditional Name: 5-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]-3-methyl-isoxazole Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=NO3)C)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=NO3)C)C

InChI

InChI=1S/C14H15N5OS/c1-9-6-11(3)19(17-9)13-4-5-14(16-15-13)21-8-12-7-10(2)18-20-12/h4-7H,8H2,1-3H3