7-ethoxy-3-methyl-8-oxidanylidene-7-(2-thiophen-3-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-ethoxy-3-methyl-8-oxidanylidene-7-(2-thiophen-3-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-ethoxy-3-methyl-8-oxo-7-[[2-(3-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-ethoxy-3-methyl-8-oxo-7-[[1-oxo-2-(3-thiophenyl)ethyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-ethoxy-3-methyl-8-oxo-7-[(2-thiophen-3-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 7-ethoxy-8-keto-3-methyl-7-[[2-(3-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C16H18N2O5S2 MolecularWeight: 382.45452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2N(C1=O)C(=C(CS2)C)C(=O)O)NC(=O)CC3=CSC=C3

Isomeric SMILES

CCOC1(C2N(C1=O)C(=C(CS2)C)C(=O)O)NC(=O)CC3=CSC=C3

InChI

InChI=1S/C16H18N2O5S2/c1-3-23-16(17-11(19)6-10-4-5-24-8-10)14(22)18-12(13(20)21)9(2)7-25-15(16)18/h4-5,8,15H,3,6-7H2,1-2H3,(H,17,19)(H,20,21)