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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=N2)C(=NC=N3)SCC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H18N4S/c1-2-7-17(8-3-1)14-27-22-21(13-26-27)23(25-16-24-22)28-15-19-11-6-10-18-9-4-5-12-20(18)19/h1-13,16H,14-15H2