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

Systemtic Name: (diphenylmethyl) 7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxidanylidene-3-[(E)-2-pyridin-2-ylethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-[[(2E)-2-(2-formamidothiazol-4-yl)-2-methoxyimino-acetyl]amino]-8-oxo-3-[(E)-2-(2-pyridyl)vinyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-[[(2E)-2-(2-formamido-4-thiazolyl)-2-methoxyimino-1-oxoethyl]amino]-8-oxo-3-[(E)-2-(2-pyridinyl)ethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-[[(2E)-2-(2-formamido-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-[(E)-2-pyridin-2-ylethenyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-[[(2E)-2-(2-formamidothiazol-4-yl)-2-methyloximino-acetyl]amino]-8-keto-3-[(E)-2-(2-pyridyl)vinyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C34H28N6O6S2 MolecularWeight: 680.75272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CON=C(C1=CSC(=N1)NC=O)C(=O)NC2C3N(C2=O)C(=C(CS3)C=CC4=CC=CC=N4)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CO/N=C(\C1=CSC(=N1)NC=O)/C(=O)NC2C3N(C2=O)C(=C(CS3)/C=C/C4=CC=CC=N4)C(=O)OC(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H28N6O6S2/c1-45-39-26(25-19-48-34(37-25)36-20-41)30(42)38-27-31(43)40-28(23(18-47-32(27)40)15-16-24-14-8-9-17-35-24)33(44)46-29(21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-17,19-20,27,29,32H,18H2,1H3,(H,38,42)(H,36,37,41)/b16-15+,39-26+