6-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1,3-benzoxathiol-2-one

Systemtic Name: 6-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1,3-benzoxathiol-2-one Openeye Name: 6-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1,3-benzoxathiol-2-one CAS Name: 6-[(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)oxy]-1,3-benzoxathiol-2-one IUPAC Name: 6-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1,3-benzoxathiol-2-one Traditional Name: 6-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)oxy-1,3-benzoxathiol-2-one Formula: C18H10N4O3S MolecularWeight: 362.362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC5=C(C=C4)SC(=O)O5

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)OC4=CC5=C(C=C4)SC(=O)O5

InChI

InChI=1S/C18H10N4O3S/c23-18-25-14-8-12(6-7-15(14)26-18)24-17-13-9-21-22(16(13)19-10-20-17)11-4-2-1-3-5-11/h1-10H