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

Systemtic Name: 1-cyano-1-[4-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1H-pyrazol-5-yl]ethanesulfonamide Openeye Name: 1-cyano-1-[4-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1H-pyrazol-5-yl]ethanesulfonamide CAS Name: 1-cyano-1-[4-[(4,6-dimethoxy-2-pyrimidinyl)thio]-1H-pyrazol-5-yl]ethanesulfonamide IUPAC Name: 1-cyano-1-[4-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-1H-pyrazol-5-yl]ethanesulfonamide Traditional Name: 1-cyano-1-[4-[(4,6-dimethoxypyrimidin-2-yl)thio]-1H-pyrazol-5-yl]ethanesulfonamide Formula: C12H14N6O4S2 MolecularWeight: 370.40736

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=C(C=NN1)SC2=NC(=CC(=N2)OC)OC)S(=O)(=O)N

Isomeric SMILES

CC(C#N)(C1=C(C=NN1)SC2=NC(=CC(=N2)OC)OC)S(=O)(=O)N

InChI

InChI=1S/C12H14N6O4S2/c1-12(6-13,24(14,19)20)10-7(5-15-18-10)23-11-16-8(21-2)4-9(17-11)22-3/h4-5H,1-3H3,(H,15,18)(H2,14,19,20)