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

Systemtic Name: 2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: 2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-benzyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C15H15N5OS MolecularWeight: 313.3775

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C15H15N5OS/c1-20-14-12(8-19-20)15(18-10-17-14)22-9-13(21)16-7-11-5-3-2-4-6-11/h2-6,8,10H,7,9H2,1H3,(H,16,21)