3-azanyl-6-(4-dimethylaminophenyl)-1-methyl-5-(4-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3-azanyl-6-(4-dimethylaminophenyl)-1-methyl-5-(4-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3-amino-6-(4-dimethylaminophenyl)-1-methyl-5-(4-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3-amino-6-(4-dimethylaminophenyl)-1-methyl-5-[4-(methylthio)phenyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 3-amino-6-(4-dimethylaminophenyl)-1-methyl-5-(4-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3-amino-6-(4-dimethylaminophenyl)-1-methyl-5-[4-(methylthio)phenyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H22N6OS MolecularWeight: 406.50398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=N1)N)C(=O)N(C(=N2)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)SC

Isomeric SMILES

CN1C2=C(C(=N1)N)C(=O)N(C(=N2)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)SC

InChI

InChI=1S/C21H22N6OS/c1-25(2)14-7-5-13(6-8-14)19-23-20-17(18(22)24-26(20)3)21(28)27(19)15-9-11-16(29-4)12-10-15/h5-12H,1-4H3,(H2,22,24)