N-(5-methyl-1,2-oxazol-3-yl)-3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(5-methylisoxazol-3-yl)-3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-(5-methyl-3-isoxazolyl)-3-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-3-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(5-methylisoxazol-3-yl)-3-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]propionamide Formula: C13H14N6O2S MolecularWeight: 318.35426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCSC2=NC=NC3=C2C=NN3C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCSC2=NC=NC3=C2C=NN3C

InChI

InChI=1S/C13H14N6O2S/c1-8-5-10(18-21-8)17-11(20)3-4-22-13-9-6-16-19(2)12(9)14-7-15-13/h5-7H,3-4H2,1-2H3,(H,17,18,20)