3,4,6-tris(methylsulfanyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 3,4,6-tris(methylsulfanyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 3,4,6-tris(methylsulfanyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 3,4,6-tris(methylthio)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 3,4,6-tris(methylsulfanyl)-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 3,4,6-tris(methylthio)-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C14H14N4S3 MolecularWeight: 334.48276

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC(=NC2=C1C(=NN2C3=CC=CC=C3)SC)SC

Isomeric SMILES

CSC1=NC(=NC2=C1C(=NN2C3=CC=CC=C3)SC)SC

InChI

InChI=1S/C14H14N4S3/c1-19-12-10-11(15-14(16-12)21-3)18(17-13(10)20-2)9-7-5-4-6-8-9/h4-8H,1-3H3