N-(2,5-dimethylpyrazol-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(2,5-dimethylpyrazol-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylpyrazol-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2,5-dimethyl-3-pyrazolyl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2,5-dimethylpyrazol-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2,5-dimethylpyrazol-3-yl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C13H15N7OS MolecularWeight: 317.3695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C)C

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C)C

InChI

InChI=1S/C13H15N7OS/c1-8-4-10(19(2)18-8)17-11(21)6-22-13-9-5-16-20(3)12(9)14-7-15-13/h4-5,7H,6H2,1-3H3,(H,17,21)