3-(4-methoxyphenyl)-4,6-bis(methylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 3-(4-methoxyphenyl)-4,6-bis(methylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidine Openeye Name: 3-(4-methoxyphenyl)-4,6-bis(methylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidine CAS Name: 3-(4-methoxyphenyl)-4,6-bis(methylthio)-2H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 3-(4-methoxyphenyl)-4,6-bis(methylsulfanyl)-2H-pyrazolo[3,4-d]pyrimidine Traditional Name: 3-(4-methoxyphenyl)-4,6-bis(methylthio)-2H-pyrazolo[3,4-d]pyrimidine Formula: C14H14N4OS2 MolecularWeight: 318.41716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(=NN2)N=C(N=C3SC)SC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(=NN2)N=C(N=C3SC)SC

InChI

InChI=1S/C14H14N4OS2/c1-19-9-6-4-8(5-7-9)11-10-12(18-17-11)15-14(21-3)16-13(10)20-2/h4-7H,1-3H3,(H,15,16,17,18)