7-azanyl-3-[(3-methylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-azanyl-3-[(3-methylthiophen-2-yl)methyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-amino-3-[(3-methyl-2-thienyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-amino-3-[(3-methyl-2-thiophenyl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-amino-3-[(3-methylthiophen-2-yl)methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-amino-8-keto-3-[(3-methyl-2-thienyl)methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C13H14N2O3S2 MolecularWeight: 310.39186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CC2=C(N3C(C(C3=O)N)SC2)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)CC2=C(N3C(C(C3=O)N)SC2)C(=O)O

InChI

InChI=1S/C13H14N2O3S2/c1-6-2-3-19-8(6)4-7-5-20-12-9(14)11(16)15(12)10(7)13(17)18/h2-3,9,12H,4-5,14H2,1H3,(H,17,18)