1-(4-methylphenyl)-6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(4-methylphenyl)-6-methylsulfanyl-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-methylsulfanyl-1-(p-tolyl)-4-pyrrolidin-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-methylphenyl)-6-(methylthio)-4-(1-pyrrolidinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-methylphenyl)-6-methylsulfanyl-4-pyrrolidin-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-(methylthio)-1-(p-tolyl)-4-pyrrolidino-pyrazolo[3,4-d]pyrimidine Formula: C17H19N5S MolecularWeight: 325.43126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)SC)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)SC)N4CCCC4

InChI

InChI=1S/C17H19N5S/c1-12-5-7-13(8-6-12)22-16-14(11-18-22)15(19-17(20-16)23-2)21-9-3-4-10-21/h5-8,11H,3-4,9-10H2,1-2H3