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

Systemtic Name: 1-(4-methylphenyl)-4-(naphthalen-1-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(1-naphthylmethylsulfanyl)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4-methylphenyl)-4-(1-naphthalenylmethylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4-methylphenyl)-4-(naphthalen-1-ylmethylsulfanyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(1-naphthylmethylthio)-1-(p-tolyl)pyrazolo[3,4-d]pyrimidine Formula: C23H18N4S MolecularWeight: 382.48082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H18N4S/c1-16-9-11-19(12-10-16)27-22-21(13-26-27)23(25-15-24-22)28-14-18-7-4-6-17-5-2-3-8-20(17)18/h2-13,15H,14H2,1H3