4-azanyl-1-(2-hydroxyethyloxymethyl)pyrazolo[3,4-d]pyrimidine-3-carbothioamide

Systemtic Name: 4-azanyl-1-(2-hydroxyethyloxymethyl)pyrazolo[3,4-d]pyrimidine-3-carbothioamide Openeye Name: 4-amino-1-(2-hydroxyethoxymethyl)pyrazolo[3,4-d]pyrimidine-3-carbothioamide CAS Name: 4-amino-1-(2-hydroxyethoxymethyl)-3-pyrazolo[3,4-d]pyrimidinecarbothioamide IUPAC Name: 4-amino-1-(2-hydroxyethoxymethyl)pyrazolo[3,4-d]pyrimidine-3-carbothioamide Traditional Name: 4-amino-1-(2-hydroxyethoxymethyl)pyrazolo[3,4-d]pyrimidine-3-carbothioamide Formula: C9H12N6O2S MolecularWeight: 268.29558

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=NN2COCCO)C(=S)N)C(=N1)N

Isomeric SMILES

C1=NC2=C(C(=NN2COCCO)C(=S)N)C(=N1)N

InChI

InChI=1S/C9H12N6O2S/c10-7-5-6(8(11)18)14-15(4-17-2-1-16)9(5)13-3-12-7/h3,16H,1-2,4H2,(H2,11,18)(H2,10,12,13)