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2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium

2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium

Systemtic Name:2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium
Openeye Name:2-[6-ethylsulfanyl-4-(isopropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium
CAS Name:2-[6-(ethylthio)-4-(propan-2-ylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethylammonium
IUPAC Name:2-[6-ethylsulfanyl-4-(propan-2-ylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium
Traditional Name:2-[6-(ethylthio)-4-(isopropylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium
Formula: C12H21N6S+
MolecularWeight: 281.40034
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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(C=NN2CC[NH3+])C(=N1)NC(C)C


Isomeric SMILES

CCSC1=NC2=C(C=NN2CC[NH3+])C(=N1)NC(C)C


InChI

InChI=1S/C12H20N6S/c1-4-19-12-16-10(15-8(2)3)9-7-14-18(6-5-13)11(9)17-12/h7-8H,4-6,13H2,1-3H3,(H,15,16,17)/p+1


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