[2-acetyloxy-4-[2-[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-carboxyoxy-7-methanethioyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]-1,3-thiazol-4-yl]phenyl] ethanoate

Systemtic Name: [2-acetyloxy-4-[2-[7-[[(2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-2-carboxyoxy-7-methanethioyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]-1,3-thiazol-4-yl]phenyl] ethanoate Openeye Name: [2-acetoxy-4-[2-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methoxyimino-acetyl]amino]-2-carboxyoxy-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thiazol-4-yl]phenyl] acetate CAS Name: acetic acid [2-acetyloxy-4-[2-[7-[[(2E)-2-(2-amino-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-2-carboxyoxy-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]-4-thiazolyl]phenyl] ester IUPAC Name: [2-acetyloxy-4-[2-[7-[[(2E)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-2-carboxyoxy-7-methanethioyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]-1,3-thiazol-4-yl]phenyl] acetate Traditional Name: acetic acid [2-acetoxy-4-[2-[7-[[(2E)-2-(2-aminothiazol-4-yl)-2-methyloximino-acetyl]amino]-2-carboxyoxy-8-keto-7-thioformyl-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thiazol-4-yl]phenyl] ester Formula: C27H22N6O10S4 MolecularWeight: 718.75778

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N4C(C(C4=O)(C=S)NC(=O)C(=NOC)C5=CSC(=N5)N)SC3)OC(=O)O)OC(=O)C

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C2=CSC(=N2)C3=C(N4C(C(C4=O)(C=S)NC(=O)/C(=N/OC)/C5=CSC(=N5)N)SC3)OC(=O)O)OC(=O)C

InChI

InChI=1S/C27H22N6O10S4/c1-11(34)41-17-5-4-13(6-18(17)42-12(2)35)15-8-45-21(29-15)14-7-46-24-27(10-44,23(37)33(24)22(14)43-26(38)39)31-20(36)19(32-40-3)16-9-47-25(28)30-16/h4-6,8-10,24H,7H2,1-3H3,(H2,28,30)(H,31,36)(H,38,39)/b32-19+