methyl 7-oxidanylidene-3-(1,2,3-triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: methyl 7-oxidanylidene-3-(1,2,3-triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: methyl 7-oxo-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 7-oxo-3-(1-triazolylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester IUPAC Name: methyl 7-oxo-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 7-keto-3-(triazol-1-ylmethyl)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid methyl ester Formula: C10H12N4O3S MolecularWeight: 268.29228

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(SC2N1C(=O)C2)CN3C=CN=N3

Isomeric SMILES

COC(=O)C1C(SC2N1C(=O)C2)CN3C=CN=N3

InChI

InChI=1S/C10H12N4O3S/c1-17-10(16)9-6(5-13-3-2-11-12-13)18-8-4-7(15)14(8)9/h2-3,6,8-9H,4-5H2,1H3