2-azanyl-3-[6-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)pyridin-2-yl]propanamide

Systemtic Name: 2-azanyl-3-[6-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)pyridin-2-yl]propanamide Openeye Name: 2-amino-3-[6-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)-2-pyridyl]propanamide CAS Name: 2-amino-3-[6-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]-2-pyridinyl]propanamide IUPAC Name: 2-amino-3-[6-(1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanylmethyl)pyridin-2-yl]propanamide Traditional Name: 2-amino-3-[6-[(1H-pyrazolo[3,4-d]pyrimidin-4-ylthio)methyl]-2-pyridyl]propionamide Formula: C14H15N7OS MolecularWeight: 329.3802

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)CSC2=NC=NC3=C2C=NN3)CC(C(=O)N)N

Isomeric SMILES

C1=CC(=NC(=C1)CSC2=NC=NC3=C2C=NN3)CC(C(=O)N)N

InChI

InChI=1S/C14H15N7OS/c15-11(12(16)22)4-8-2-1-3-9(20-8)6-23-14-10-5-19-21-13(10)17-7-18-14/h1-3,5,7,11H,4,6,15H2,(H2,16,22)(H,17,18,19,21)