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

Systemtic Name: 1-(4-methylphenyl)-6-methylsulfanyl-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-methylsulfanyl-4-(1-piperidyl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-methylphenyl)-6-(methylthio)-4-(1-piperidinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-methylphenyl)-6-methylsulfanyl-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-(methylthio)-4-piperidino-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)SC)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC(=N3)SC)N4CCCCC4

InChI

InChI=1S/C18H21N5S/c1-13-6-8-14(9-7-13)23-17-15(12-19-23)16(20-18(21-17)24-2)22-10-4-3-5-11-22/h6-9,12H,3-5,10-11H2,1-2H3