5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-(4-methoxyphenyl)-1,2-oxazole

Systemtic Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-(4-methoxyphenyl)-1,2-oxazole Openeye Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-(4-methoxyphenyl)isoxazole CAS Name: 5-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]-3-(4-methoxyphenyl)isoxazole IUPAC Name: 5-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]-3-(4-methoxyphenyl)-1,2-oxazole Traditional Name: 5-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]-3-(4-methoxyphenyl)isoxazole Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=NO3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=NO3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C20H19N5O2S/c1-13-10-14(2)25(23-13)19-8-9-20(22-21-19)28-12-17-11-18(24-27-17)15-4-6-16(26-3)7-5-15/h4-11H,12H2,1-3H3