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

Systemtic Name: [2-(6-chloranylpyridazin-3-yl)-5-methyl-4-(1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate Openeye Name: [2-(6-chloropyridazin-3-yl)-5-methyl-4-(1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(6-chloro-3-pyridazinyl)-5-methyl-4-(1-methylsulfonyl-4H-pyridin-4-yl)-3-pyrazolyl] ester IUPAC Name: [2-(6-chloropyridazin-3-yl)-5-methyl-4-(1-methylsulfonyl-4H-pyridin-4-yl)pyrazol-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(6-chloropyridazin-3-yl)-4-(1-mesyl-4H-pyridin-4-yl)-5-methyl-pyrazol-3-yl] ester Formula: C15H16ClN5O5S2 MolecularWeight: 445.90104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2C=CN(C=C2)S(=O)(=O)C)OS(=O)(=O)C)C3=NN=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1C2C=CN(C=C2)S(=O)(=O)C)OS(=O)(=O)C)C3=NN=C(C=C3)Cl

InChI

InChI=1S/C15H16ClN5O5S2/c1-10-14(11-6-8-20(9-7-11)27(2,22)23)15(26-28(3,24)25)21(19-10)13-5-4-12(16)17-18-13/h4-9,11H,1-3H3