(7E)-3-methyl-7-(4-methylphenyl)sulfanylimino-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: (7E)-3-methyl-7-(4-methylphenyl)sulfanylimino-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: (7E)-3-methyl-8-oxo-7-(p-tolylsulfanylimino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: (7E)-3-methyl-7-[(4-methylphenyl)thio]imino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: (7E)-3-methyl-7-(4-methylphenyl)sulfanylimino-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: (7E)-8-keto-3-methyl-7-(p-tolylthio)imino-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H14N2O3S2 MolecularWeight: 334.41326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(C(=NSC3=CC=C(C=C3)C)C2=O)SC1)C(=O)O

Isomeric SMILES

CC1=C(N2C(/C(=N/SC3=CC=C(C=C3)C)/C2=O)SC1)C(=O)O

InChI

InChI=1S/C15H14N2O3S2/c1-8-3-5-10(6-4-8)22-16-11-13(18)17-12(15(19)20)9(2)7-21-14(11)17/h3-6,14H,7H2,1-2H3,(H,19,20)/b16-11+