7-methyl-7-(5-methylsulfanylimidazo[1,2-a]pyridin-4-ium-1-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-methyl-7-(5-methylsulfanylimidazo[1,2-a]pyridin-4-ium-1-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-methyl-7-(5-methylsulfanylimidazo[1,2-a]pyridin-4-ium-1-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-methyl-7-[5-(methylthio)-1-imidazo[1,2-a]pyridin-4-iumyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-methyl-7-(5-methylsulfanylimidazo[1,2-a]pyridin-4-ium-1-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-7-methyl-7-[5-(methylthio)imidazo[1,2-a]pyridin-4-ium-1-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2N(C1=O)C(=CCS2)C(=O)[O-])N3C=C[N+]4=C3C=CC=C4SC

Isomeric SMILES

CC1(C2N(C1=O)C(=CCS2)C(=O)[O-])N3C=C[N+]4=C3C=CC=C4SC

InChI

InChI=1S/C16H15N3O3S2/c1-16(14(22)19-10(13(20)21)6-9-24-15(16)19)18-8-7-17-11(18)4-3-5-12(17)23-2/h3-8,15H,9H2,1-2H3