1-(4-methylpiperidin-1-yl)-2-[6-(4-pyrazol-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-methylpiperidin-1-yl)-2-[6-(4-pyrazol-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-(4-methyl-1-piperidyl)-2-[6-(4-pyrazol-1-ylphenyl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(4-methyl-1-piperidinyl)-2-[[6-[4-(1-pyrazolyl)phenyl]-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(4-methylpiperidin-1-yl)-2-[6-(4-pyrazol-1-ylphenyl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-(4-methylpiperidino)-2-[[6-(4-pyrazol-1-ylphenyl)pyridazin-3-yl]thio]ethanone Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NN=C(C=C2)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H23N5OS/c1-16-9-13-25(14-10-16)21(27)15-28-20-8-7-19(23-24-20)17-3-5-18(6-4-17)26-12-2-11-22-26/h2-8,11-12,16H,9-10,13-15H2,1H3