[(6R,7R)-2-(diphenylmethyl)oxycarbonyl-7-[[(2Z)-2-hydroxyimino-2-[2-[(triphenylmethyl)amino]-1,3-thiazol-4-yl]ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl morpholine-4-carboxylate

Systemtic Name: [(6R,7R)-2-(diphenylmethyl)oxycarbonyl-7-[[(2Z)-2-hydroxyimino-2-[2-[(triphenylmethyl)amino]-1,3-thiazol-4-yl]ethanoyl]amino]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl morpholine-4-carboxylate Openeye Name: [(6R,7R)-2-benzhydryloxycarbonyl-7-[[(2Z)-2-hydroxyimino-2-[2-(tritylamino)thiazol-4-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl morpholine-4-carboxylate CAS Name: 4-morpholinecarboxylic acid [(6R,7R)-2-[(diphenylmethyl)oxy-oxomethyl]-7-[[(2Z)-2-hydroxyimino-1-oxo-2-[2-[(triphenylmethyl)amino]-4-thiazolyl]ethyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl ester IUPAC Name: [(6R,7R)-2-benzhydryloxycarbonyl-7-[[(2Z)-2-hydroxyimino-2-[2-(tritylamino)-1,3-thiazol-4-yl]acetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl morpholine-4-carboxylate Traditional Name: morpholine-4-carboxylic acid [(6R,7R)-2-benzhydryloxycarbonyl-7-[[(2Z)-2-hydroximino-2-[2-(tritylamino)thiazol-4-yl]acetyl]amino]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl ester Formula: C50H44N6O8S2 MolecularWeight: 921.04976

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)OCC2=C(N3C(C(C3=O)NC(=O)C(=NO)C4=CSC(=N4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)SC2)C(=O)OC(C8=CC=CC=C8)C9=CC=CC=C9

Isomeric SMILES

C1COCCN1C(=O)OCC2=C(N3[C@@H]([C@@H](C3=O)NC(=O)/C(=N\O)/C4=CSC(=N4)NC(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)SC2)C(=O)OC(C8=CC=CC=C8)C9=CC=CC=C9

InChI

InChI=1S/C50H44N6O8S2/c57-44(40(54-61)39-32-66-48(51-39)53-50(36-20-10-3-11-21-36,37-22-12-4-13-23-37)38-24-14-5-15-25-38)52-41-45(58)56-42(35(31-65-46(41)56)30-63-49(60)55-26-28-62-29-27-55)47(59)64-43(33-16-6-1-7-17-33)34-18-8-2-9-19-34/h1-25,32,41,43,46,61H,26-31H2,(H,51,53)(H,52,57)/b54-40-/t41-,46-/m1/s1