2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(m-tolyl)piperazin-1-yl]ethanone CAS Name: 2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-1-[4-(3-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(3-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-1-[4-(m-tolyl)piperazino]ethanone Formula: C22H26N6OS MolecularWeight: 422.54644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NN=C(C=C3)N4C(=CC(=N4)C)C

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NN=C(C=C3)N4C(=CC(=N4)C)C

InChI

InChI=1S/C22H26N6OS/c1-16-5-4-6-19(13-16)26-9-11-27(12-10-26)22(29)15-30-21-8-7-20(23-24-21)28-18(3)14-17(2)25-28/h4-8,13-14H,9-12,15H2,1-3H3