1-methyl-4-(2-pyridin-4-ylethylsulfanyl)pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-methyl-4-(2-pyridin-4-ylethylsulfanyl)pyrazolo[3,4-d]pyrimidine Openeye Name: 1-methyl-4-[2-(4-pyridyl)ethylsulfanyl]pyrazolo[3,4-d]pyrimidine CAS Name: 1-methyl-4-(2-pyridin-4-ylethylthio)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-methyl-4-(2-pyridin-4-ylethylsulfanyl)pyrazolo[3,4-d]pyrimidine Traditional Name: 1-methyl-4-[2-(4-pyridyl)ethylthio]pyrazolo[3,4-d]pyrimidine Formula: C13H13N5S MolecularWeight: 271.34082

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)SCCC3=CC=NC=C3

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)SCCC3=CC=NC=C3

InChI

InChI=1S/C13H13N5S/c1-18-12-11(8-17-18)13(16-9-15-12)19-7-4-10-2-5-14-6-3-10/h2-3,5-6,8-9H,4,7H2,1H3