3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-6-(3,5-dimethyl-1-pyrazolyl)pyridazine IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-6-(3,5-dimethylpyrazol-1-yl)pyridazine Traditional Name: 3-(2-brosylethylthio)-6-(3,5-dimethylpyrazol-1-yl)pyridazine Formula: C17H17BrN4O2S2 MolecularWeight: 453.37648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCCS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCCS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C17H17BrN4O2S2/c1-12-11-13(2)22(21-12)16-7-8-17(20-19-16)25-9-10-26(23,24)15-5-3-14(18)4-6-15/h3-8,11H,9-10H2,1-2H3