[4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazin-1-yl]-(2-methylsulfanylphenyl)methanone CAS Name: [4-(6-cyclohexyloxy-3-pyridazinyl)-1-piperazinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [4-(6-cyclohexyloxypyridazin-3-yl)piperazin-1-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [4-[6-(cyclohexoxy)pyridazin-3-yl]piperazino]-[2-(methylthio)phenyl]methanone Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NN=C(C=C3)OC4CCCCC4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NN=C(C=C3)OC4CCCCC4

InChI

InChI=1S/C22H28N4O2S/c1-29-19-10-6-5-9-18(19)22(27)26-15-13-25(14-16-26)20-11-12-21(24-23-20)28-17-7-3-2-4-8-17/h5-6,9-12,17H,2-4,7-8,13-16H2,1H3