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

Systemtic Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Openeye Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone CAS Name: 2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]-1-[4-(2-phenoxyethyl)-1-piperazinyl]ethanone IUPAC Name: 2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-1-[4-(2-phenoxyethyl)piperazin-1-yl]ethanone Traditional Name: 2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]-1-[4-(2-phenoxyethyl)piperazino]ethanone Formula: C23H28N6O2S MolecularWeight: 452.57242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)N3CCN(CC3)CCOC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)SCC(=O)N3CCN(CC3)CCOC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N6O2S/c1-18-16-19(2)29(26-18)21-8-9-22(25-24-21)32-17-23(30)28-12-10-27(11-13-28)14-15-31-20-6-4-3-5-7-20/h3-9,16H,10-15,17H2,1-2H3