4-(phenylmethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(phenylmethylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-benzylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(phenylmethylthio)-1H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-benzylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(benzylthio)-1H-pyrazolo[3,4-d]pyrimidine Formula: C12H10N4S MolecularWeight: 242.2996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC=NC3=C2C=NN3

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC=NC3=C2C=NN3

InChI

InChI=1S/C12H10N4S/c1-2-4-9(5-3-1)7-17-12-10-6-15-16-11(10)13-8-14-12/h1-6,8H,7H2,(H,13,14,15,16)