4-butylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-butylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-butylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(butylthio)-1H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-butylsulfanyl-1H-pyrazolo[3,4-d]pyrimidine Traditional Name: 4-(butylthio)-1H-pyrazolo[3,4-d]pyrimidine Formula: C9H12N4S MolecularWeight: 208.28338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC=NC2=C1C=NN2

Isomeric SMILES

CCCCSC1=NC=NC2=C1C=NN2

InChI

InChI=1S/C9H12N4S/c1-2-3-4-14-9-7-5-12-13-8(7)10-6-11-9/h5-6H,2-4H2,1H3,(H,10,11,12,13)