7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methyl-4-[[(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methyl-4-[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-methyl-4-[[(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)thio]methyl]coumarin Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=NC4=C3C=NN4C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C17H14N4O2S/c1-10-3-4-12-11(6-15(22)23-14(12)5-10)8-24-17-13-7-20-21(2)16(13)18-9-19-17/h3-7,9H,8H2,1-2H3