1-[2-(2-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylpropan-2-one

Systemtic Name: 1-[2-(2-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylpropan-2-one Openeye Name: 1-[2-(2-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylpropan-2-one CAS Name: 1-[[2-(2-chlorophenyl)-3,4-dimethyl-7-pyrazolo[3,4-d]pyridazinyl]thio]-2-propanone IUPAC Name: 1-[2-(2-chlorophenyl)-3,4-dimethylpyrazolo[3,4-d]pyridazin-7-yl]sulfanylpropan-2-one Traditional Name: 1-[[2-(2-chlorophenyl)-3,4-dimethyl-pyrazolo[3,4-d]pyridazin-7-yl]thio]acetone Formula: C16H15ClN4OS MolecularWeight: 346.8345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=NN=C(C2=NN1C3=CC=CC=C3Cl)SCC(=O)C)C

Isomeric SMILES

CC1=C2C(=NN=C(C2=NN1C3=CC=CC=C3Cl)SCC(=O)C)C

InChI

InChI=1S/C16H15ClN4OS/c1-9(22)8-23-16-15-14(10(2)18-19-16)11(3)21(20-15)13-7-5-4-6-12(13)17/h4-7H,8H2,1-3H3