4-[3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]phenyl]sulfonylmorpholine

Systemtic Name: 4-[3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]phenyl]sulfonylmorpholine Openeye Name: 4-[3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]phenyl]sulfonylmorpholine CAS Name: 4-[3-[[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]methyl]phenyl]sulfonylmorpholine IUPAC Name: 4-[3-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylmethyl]phenyl]sulfonylmorpholine Traditional Name: 4-[3-[[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]methyl]phenyl]sulfonylmorpholine Formula: C20H23N5O3S2 MolecularWeight: 445.55832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C20H23N5O3S2/c1-15-12-16(2)25(23-15)19-6-7-20(22-21-19)29-14-17-4-3-5-18(13-17)30(26,27)24-8-10-28-11-9-24/h3-7,12-13H,8-11,14H2,1-2H3