7-[[(2Z)-2-(2-methoxy-2-oxidanylidene-ethoxy)imino-2-[2-(methylamino)-1,3-thiazol-4-yl]ethanoyl]amino]-3-methylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 7-[[(2Z)-2-(2-methoxy-2-oxidanylidene-ethoxy)imino-2-[2-(methylamino)-1,3-thiazol-4-yl]ethanoyl]amino]-3-methylsulfanyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 7-[[(2Z)-2-(2-methoxy-2-oxo-ethoxy)imino-2-[2-(methylamino)thiazol-4-yl]acetyl]amino]-3-methylsulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 7-[[(2Z)-2-(2-methoxy-2-oxoethoxy)imino-2-[2-(methylamino)-4-thiazolyl]-1-oxoethyl]amino]-3-(methylthio)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 7-[[(2Z)-2-(2-methoxy-2-oxoethoxy)imino-2-[2-(methylamino)-1,3-thiazol-4-yl]acetyl]amino]-3-methylsulfanyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 8-keto-7-[[(2Z)-2-(2-keto-2-methoxy-ethyl)oximino-2-[2-(methylamino)thiazol-4-yl]acetyl]amino]-3-(methylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C17H19N5O7S3 MolecularWeight: 501.55706

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=CS1)C(=NOCC(=O)OC)C(=O)NC2C3N(C2=O)C(=C(CS3)SC)C(=O)O

Isomeric SMILES

CNC1=NC(=CS1)/C(=N/OCC(=O)OC)/C(=O)NC2C3N(C2=O)C(=C(CS3)SC)C(=O)O

InChI

InChI=1S/C17H19N5O7S3/c1-18-17-19-7(5-32-17)10(21-29-4-9(23)28-2)13(24)20-11-14(25)22-12(16(26)27)8(30-3)6-31-15(11)22/h5,11,15H,4,6H2,1-3H3,(H,18,19)(H,20,24)(H,26,27)/b21-10-