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

Systemtic Name: N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-methyl-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-methyl-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-benzyl-N-methyl-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C16H17N5OS/c1-20(9-12-6-4-3-5-7-12)14(22)10-23-16-13-8-19-21(2)15(13)17-11-18-16/h3-8,11H,9-10H2,1-2H3