[2-(6-chloranylpyridazin-3-yl)-5-methyl-4-(3-methyl-1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate

Systemtic Name: [2-(6-chloranylpyridazin-3-yl)-5-methyl-4-(3-methyl-1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate Openeye Name: [2-(6-chloropyridazin-3-yl)-5-methyl-4-(3-methyl-1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(6-chloro-3-pyridazinyl)-5-methyl-4-(3-methyl-1-methylsulfonyl-4H-pyridin-4-yl)-3-pyrazolyl] ester IUPAC Name: [2-(6-chloropyridazin-3-yl)-5-methyl-4-(3-methyl-1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(6-chloropyridazin-3-yl)-4-(1-mesyl-3-methyl-4H-pyridin-4-yl)-5-methyl-pyrazol-3-yl] ester Formula: C16H18ClN5O5S2 MolecularWeight: 459.92762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=CC1C2=C(N(N=C2C)C3=NN=C(C=C3)Cl)OS(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CC1=CN(C=CC1C2=C(N(N=C2C)C3=NN=C(C=C3)Cl)OS(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C16H18ClN5O5S2/c1-10-9-21(28(3,23)24)8-7-12(10)15-11(2)20-22(16(15)27-29(4,25)26)14-6-5-13(17)18-19-14/h5-9,12H,1-4H3