1-cyano-1-[3-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide

Systemtic Name: 1-cyano-1-[3-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide Openeye Name: 1-cyano-1-[3-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide CAS Name: 1-cyano-1-[3-[(4,6-dimethoxy-2-pyrimidinyl)thio]-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide IUPAC Name: 1-cyano-1-[3-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide Traditional Name: 1-cyano-1-[3-[(4,6-dimethoxypyrimidin-2-yl)thio]-5-methyl-1H-pyrazol-4-yl]ethanesulfonamide Formula: C13H16N6O4S2 MolecularWeight: 384.43394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)SC2=NC(=CC(=N2)OC)OC)C(C)(C#N)S(=O)(=O)N

Isomeric SMILES

CC1=C(C(=NN1)SC2=NC(=CC(=N2)OC)OC)C(C)(C#N)S(=O)(=O)N

InChI

InChI=1S/C13H16N6O4S2/c1-7-10(13(2,6-14)25(15,20)21)11(19-18-7)24-12-16-8(22-3)5-9(17-12)23-4/h5H,1-4H3,(H,18,19)(H2,15,20,21)