(2S)-2-azanyl-4-methylsulfanyl-butanoic acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: (2S)-2-azanyl-4-methylsulfanyl-butanoic acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: (2S)-2-amino-4-methylsulfanyl-butanoic acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: (2S)-2-amino-4-(methylthio)butanoic acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: (2S)-2-amino-4-methylsulfanylbutanoic acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: (2S)-2-amino-4-(methylthio)butyric acid; 1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C10H15N5O3S MolecularWeight: 285.3228

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)N.C1=C2C(=NC=NC2=O)NN1

Isomeric SMILES

CSCC[C@@H](C(=O)O)N.C1=C2C(=NC=NC2=O)NN1

InChI

InChI=1S/C5H4N4O.C5H11NO2S/c10-5-3-1-8-9-4(3)6-2-7-5;1-9-3-2-4(6)5(7)8/h1-2H,(H2,6,7,8,9,10);4H,2-3,6H2,1H3,(H,7,8)/t;4-/m.0/s1