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

Systemtic Name: 4-[(4-methylphenyl)methylsulfanyl]-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-benzyl-4-(p-tolylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine CAS Name: 4-[(4-methylphenyl)methylthio]-1-(phenylmethyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-benzyl-4-[(4-methylphenyl)methylsulfanyl]pyrazolo[3,4-d]pyrimidine Traditional Name: 1-benzyl-4-[(4-methylbenzyl)thio]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)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4

InChI

InChI=1S/C20H18N4S/c1-15-7-9-17(10-8-15)13-25-20-18-11-23-24(19(18)21-14-22-20)12-16-5-3-2-4-6-16/h2-11,14H,12-13H2,1H3