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

Systemtic Name: N-(2-methoxydibenzofuran-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-ethanamide Openeye Name: N-(2-methoxydibenzofuran-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-acetamide CAS Name: N-(2-methoxy-3-dibenzofuranyl)-2-[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-methoxydibenzofuran-3-yl)-2-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylacetamide Traditional Name: N-(2-methoxydibenzofuran-3-yl)-2-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]acetamide Formula: C21H17N5O3S MolecularWeight: 419.45638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NC3=C(C=C4C5=CC=CC=C5OC4=C3)OC

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC(=O)NC3=C(C=C4C5=CC=CC=C5OC4=C3)OC

InChI

InChI=1S/C21H17N5O3S/c1-26-20-14(9-24-26)21(23-11-22-20)30-10-19(27)25-15-8-17-13(7-18(15)28-2)12-5-3-4-6-16(12)29-17/h3-9,11H,10H2,1-2H3,(H,25,27)