(diphenylmethyl) 7-azanyl-3-[[5-[2-(diphenylmethyl)oxy-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-azanyl-3-[[5-[2-(diphenylmethyl)oxy-2-oxidanylidene-ethyl]-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-amino-3-[[5-(2-benzhydryloxy-2-oxo-ethyl)-4-methyl-thiazol-2-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-[[[5-[2-(diphenylmethyl)oxy-2-oxoethyl]-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-amino-3-[[5-(2-benzhydryloxy-2-oxoethyl)-4-methyl-1,3-thiazol-2-yl]sulfanylmethyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-3-[[[5-(2-benzhydryloxy-2-keto-ethyl)-4-methyl-thiazol-2-yl]thio]methyl]-8-keto-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C40H35N3O5S3 MolecularWeight: 733.918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)CC(=O)OC(C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CC1=C(SC(=N1)SCC2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)CC(=O)OC(C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C40H35N3O5S3/c1-25-31(22-32(44)47-35(26-14-6-2-7-15-26)27-16-8-3-9-17-27)51-40(42-25)50-24-30-23-49-38-33(41)37(45)43(38)34(30)39(46)48-36(28-18-10-4-11-19-28)29-20-12-5-13-21-29/h2-21,33,35-36,38H,22-24,41H2,1H3