7-[2-[4-(bromomethyl)phenyl]ethanoylamino]-3-[2-(bromomethyl)phenyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: 7-[2-[4-(bromomethyl)phenyl]ethanoylamino]-3-[2-(bromomethyl)phenyl]sulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: 7-[[2-[4-(bromomethyl)phenyl]acetyl]amino]-3-[2-(bromomethyl)phenyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[2-[4-(bromomethyl)phenyl]-1-oxoethyl]amino]-3-[[2-(bromomethyl)phenyl]thio]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate IUPAC Name: 7-[[2-[4-(bromomethyl)phenyl]acetyl]amino]-3-[2-(bromomethyl)phenyl]sulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[2-[4-(bromomethyl)phenyl]acetyl]amino]-3-[[2-(bromomethyl)phenyl]thio]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Formula: C23H19Br2N2O4S2- MolecularWeight: 611.34596

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=C(C=C3)CBr)C(=O)[O-])SC4=CC=CC=C4CBr

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=C(C=C3)CBr)C(=O)[O-])SC4=CC=CC=C4CBr

InChI

InChI=1S/C23H20Br2N2O4S2/c24-10-14-7-5-13(6-8-14)9-18(28)26-19-21(29)27-20(23(30)31)17(12-32-22(19)27)33-16-4-2-1-3-15(16)11-25/h1-8,19,22H,9-12H2,(H,26,28)(H,30,31)/p-1