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

Systemtic Name: 1-(4-methylphenyl)-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(m-tolylmethylsulfanyl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-methylphenyl)-4-[(3-methylphenyl)methylthio]pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-methylphenyl)-4-[(3-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[(3-methylbenzyl)thio]-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C20H18N4S MolecularWeight: 346.44872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC(=C4)C

InChI

InChI=1S/C20H18N4S/c1-14-6-8-17(9-7-14)24-19-18(11-23-24)20(22-13-21-19)25-12-16-5-3-4-15(2)10-16/h3-11,13H,12H2,1-2H3