4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-thiophen-2-yl-butan-1-one

Systemtic Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-thiophen-2-yl-butan-1-one Openeye Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-(2-thienyl)butan-1-one CAS Name: 4-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-1-thiophen-2-yl-1-butanone IUPAC Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-thiophen-2-ylbutan-1-one Traditional Name: 4-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-1-(2-thienyl)butan-1-one Formula: C17H18N4OS2 MolecularWeight: 358.48102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCCCC(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCCCC(=O)C3=CC=CS3)C

InChI

InChI=1S/C17H18N4OS2/c1-12-11-13(2)21(20-12)16-7-8-17(19-18-16)24-10-3-5-14(22)15-6-4-9-23-15/h4,6-9,11H,3,5,10H2,1-2H3