(2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate

Systemtic Name: (2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate Openeye Name: (2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: (2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]propanoate IUPAC Name: (2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate Traditional Name: (2S)-2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]propionate Formula: C8H10N3O2S- MolecularWeight: 212.2489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NNC(=N1)C2CC2

Isomeric SMILES

C[C@@H](C(=O)[O-])SC1=NNC(=N1)C2CC2

InChI

InChI=1S/C8H11N3O2S/c1-4(7(12)13)14-8-9-6(10-11-8)5-2-3-5/h4-5H,2-3H2,1H3,(H,12,13)(H,9,10,11)/p-1/t4-/m0/s1