2-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2,3-dihydroinden-1-one

Systemtic Name: 2-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2,3-dihydroinden-1-one Openeye Name: 2-(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanylindan-1-one CAS Name: 2-[(6-ethyl-1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)thio]-2,3-dihydroinden-1-one IUPAC Name: 2-(6-ethyl-1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl-2,3-dihydroinden-1-one Traditional Name: 2-[(6-ethyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)thio]indan-1-one Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC4CC5=CC=CC=C5C4=O

Isomeric SMILES

CCC1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)SC4CC5=CC=CC=C5C4=O

InChI

InChI=1S/C22H18N4OS/c1-2-19-24-21-17(13-23-26(21)15-9-4-3-5-10-15)22(25-19)28-18-12-14-8-6-7-11-16(14)20(18)27/h3-11,13,18H,2,12H2,1H3