(diphenylmethyl) 3-[2,2-bis(bromanyl)ethenyl]-7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 3-[2,2-bis(bromanyl)ethenyl]-7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 3-(2,2-dibromovinyl)-7-[[(2E)-2-(2-formamidothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 3-(2,2-dibromoethenyl)-7-[[(2E)-2-(2-formamido-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 3-(2,2-dibromoethenyl)-7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 3-(2,2-dibromovinyl)-7-[[(2E)-2-(2-formamidothiazol-4-yl)-2-methyloximino-acetyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C29H23Br2N5O6S2 MolecularWeight: 761.46082

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)NC=O)C(=O)NC2C3N(C2=O)C(=C(CS3)C=C(Br)Br)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)NC=O)/C(=O)NC2C3N(C2=O)C(=C(CS3)C=C(Br)Br)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H23Br2N5O6S2/c1-41-35-21(19-14-44-29(33-19)32-15-37)25(38)34-22-26(39)36-23(18(12-20(30)31)13-43-27(22)36)28(40)42-24(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-12,14-15,22,24,27H,13H2,1H3,(H,34,38)(H,32,33,37)/b35-21+