1-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 1-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 1-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 1-(4-methoxyphenyl)-N-[2-(methylthio)phenyl]-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(4-methoxyphenyl)-N-(2-methylsulfanylphenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: [1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-[2-(methylthio)phenyl]amine Formula: C19H17N5OS MolecularWeight: 363.43618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=CC=C4SC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)NC4=CC=CC=C4SC

InChI

InChI=1S/C19H17N5OS/c1-25-14-9-7-13(8-10-14)24-19-15(11-22-24)18(20-12-21-19)23-16-5-3-4-6-17(16)26-2/h3-12H,1-2H3,(H,20,21,23)