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

Systemtic Name: N-(furan-2-ylmethyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-furylmethyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2-furanylmethyl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(furan-2-ylmethyl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2-furfuryl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NCC3=CC=CO3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NCC3=CC=CO3

InChI

InChI=1S/C13H13N5O2S/c1-18-12-10(6-17-18)13(16-8-15-12)21-7-11(19)14-5-9-3-2-4-20-9/h2-4,6,8H,5,7H2,1H3,(H,14,19)