3-(1-methyl-1,2,3,4-tetrazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one

Systemtic Name: 3-(1-methyl-1,2,3,4-tetrazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Openeye Name: 3-(1-methyltetrazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one CAS Name: 3-(1-methyl-5-tetrazolyl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one IUPAC Name: 3-(1-methyltetrazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Traditional Name: 3-(1-methyltetrazol-5-yl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-8-one Formula: C8H9N5OS MolecularWeight: 223.25496

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)C2=CN3C(CC3=O)SC2

Isomeric SMILES

CN1C(=NN=N1)C2=CN3C(CC3=O)SC2

InChI

InChI=1S/C8H9N5OS/c1-12-8(9-10-11-12)5-3-13-6(14)2-7(13)15-4-5/h3,7H,2,4H2,1H3