3-(chloromethyl)-4-[[(2Z)-2-fluoranyl-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-4-[5-[(triphenylmethyl)amino]-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Systemtic Name: 3-(chloromethyl)-4-[[(2Z)-2-fluoranyl-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-4-[5-[(triphenylmethyl)amino]-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Openeye Name: 3-(chloromethyl)-4-[[(2Z)-2-fluoro-2-methoxyimino-acetyl]amino]-8-oxo-4-[5-(tritylamino)-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid CAS Name: 3-(chloromethyl)-4-[[(2Z)-2-fluoro-2-methoxyimino-1-oxoethyl]amino]-8-oxo-4-[5-[(triphenylmethyl)amino]-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid IUPAC Name: 3-(chloromethyl)-4-[[(2Z)-2-fluoro-2-methoxyiminoacetyl]amino]-8-oxo-4-[5-(tritylamino)-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Traditional Name: 3-(chloromethyl)-4-[[(2Z)-2-fluoro-2-methyloximino-acetyl]amino]-8-keto-4-[5-(tritylamino)-1,2,4-thiadiazol-3-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Formula: C32H26ClFN6O5S2 MolecularWeight: 693.167443

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C(=O)NC1(C(=C(N2C(S1)CC2=O)C(=O)O)CCl)C3=NSC(=N3)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)F

Isomeric SMILES

CO/N=C(/C(=O)NC1(C(=C(N2C(S1)CC2=O)C(=O)O)CCl)C3=NSC(=N3)NC(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6)\F

InChI

InChI=1S/C32H26ClFN6O5S2/c1-45-38-26(34)27(42)36-32(22(18-33)25(28(43)44)40-23(41)17-24(40)46-32)29-35-30(47-39-29)37-31(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,24H,17-18H2,1H3,(H,36,42)(H,43,44)(H,35,37,39)/b38-26-