[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-(oxolan-3-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate

Systemtic Name: [7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-(oxolan-3-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate Openeye Name: [7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-(tetrahydrofuran-3-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate CAS Name: carbonic acid [7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-3-(3-oxolanylmethylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] ester IUPAC Name: [7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-(oxolan-3-ylmethylsulfanyl)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] hydrogen carbonate Traditional Name: carbonic acid [7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-8-keto-3-(tetrahydrofuran-3-ylmethylthio)-5-thia-1-azabicyclo[4.2.0]oct-2-en-2-yl] ester Formula: C18H21N5O7S3 MolecularWeight: 515.58364

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)N)C(=O)NC2C3N(C2=O)C(=C(CS3)SCC4CCOC4)OC(=O)O

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)N)/C(=O)NC2C3N(C2=O)C(=C(CS3)SCC4CCOC4)OC(=O)O

InChI

InChI=1S/C18H21N5O7S3/c1-28-22-11(9-6-33-17(19)20-9)13(24)21-12-14(25)23-15(30-18(26)27)10(7-32-16(12)23)31-5-8-2-3-29-4-8/h6,8,12,16H,2-5,7H2,1H3,(H2,19,20)(H,21,24)(H,26,27)/b22-11+