3-(aminocarbonylamino)-7-benzamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(aminocarbonylamino)-7-benzamido-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-benzamido-8-oxo-3-ureido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-benzamido-3-(carbamoylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-benzamido-3-(carbamoylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-benzamido-8-keto-3-ureido-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C15H14N4O5S MolecularWeight: 362.36046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)C3=CC=CC=C3)C(=O)O)NC(=O)N

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)C3=CC=CC=C3)C(=O)O)NC(=O)N

InChI

InChI=1S/C15H14N4O5S/c16-15(24)17-8-6-25-13-9(12(21)19(13)10(8)14(22)23)18-11(20)7-4-2-1-3-5-7/h1-5,9,13H,6H2,(H,18,20)(H,22,23)(H3,16,17,24)