6-(2-diethylaminoethylsulfanyl)-1-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-(2-diethylaminoethylsulfanyl)-1-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(2-diethylaminoethylsulfanyl)-1-(m-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(2-diethylaminoethylthio)-1-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(2-diethylaminoethylsulfanyl)-1-(3-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(2-diethylaminoethylthio)-1-(m-tolyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C18H23N5OS MolecularWeight: 357.47312

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=CC(=C3)C

Isomeric SMILES

CCN(CC)CCSC1=NC(=O)C2=CNN(C2=N1)C3=CC=CC(=C3)C

InChI

InChI=1S/C18H23N5OS/c1-4-22(5-2)9-10-25-18-20-16-15(17(24)21-18)12-19-23(16)14-8-6-7-13(3)11-14/h6-8,11-12,19H,4-5,9-10H2,1-3H3