4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one

Systemtic Name: 4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Openeye Name: 4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one CAS Name: 4-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-2-one IUPAC Name: 4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Traditional Name: 4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one Formula: C19H16N4O2S MolecularWeight: 364.42094

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCC3=CC(=O)OC4=CC5=C(CCC5)C=C34

InChI

InChI=1S/C19H16N4O2S/c1-23-18-15(8-22-23)19(21-10-20-18)26-9-13-7-17(24)25-16-6-12-4-2-3-11(12)5-14(13)16/h5-8,10H,2-4,9H2,1H3