(1-ethoxy-1-oxidanylidene-propan-2-yl) 7-[[(2E)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-cyclopent-2-en-1-yloxyimino-ethanoyl]amino]-4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (1-ethoxy-1-oxidanylidene-propan-2-yl) 7-[[(2E)-2-(5-azanyl-1,2,4-thiadiazol-3-yl)-2-cyclopent-2-en-1-yloxyimino-ethanoyl]amino]-4-methyl-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: (2-ethoxy-1-methyl-2-oxo-ethyl) 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-cyclopent-2-en-1-yloxyimino-acetyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(1-cyclopent-2-enyloxyimino)-1-oxoethyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (1-ethoxy-1-oxopropan-2-yl) ester IUPAC Name: (1-ethoxy-1-oxopropan-2-yl) 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-cyclopent-2-en-1-yloxyiminoacetyl]amino]-4-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-cyclopent-2-en-1-yloximino-acetyl]amino]-8-keto-4-methyl-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (2-ethoxy-2-keto-1-methyl-ethyl) ester Formula: C22H26N6O7S2 MolecularWeight: 550.60784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)OC(=O)C1=CC(SC2N1C(=O)C2NC(=O)C(=NOC3CCC=C3)C4=NSC(=N4)N)C

Isomeric SMILES

CCOC(=O)C(C)OC(=O)C1=CC(SC2N1C(=O)C2NC(=O)/C(=N/OC3CCC=C3)/C4=NSC(=N4)N)C

InChI

InChI=1S/C22H26N6O7S2/c1-4-33-20(31)11(3)34-21(32)13-9-10(2)36-19-15(18(30)28(13)19)24-17(29)14(16-25-22(23)37-27-16)26-35-12-7-5-6-8-12/h5,7,9-12,15,19H,4,6,8H2,1-3H3,(H,24,29)(H2,23,25,27)/b26-14+