(diphenylmethyl) 7-azanyl-3-(2-methylsulfanyl-1,3-thiazol-5-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-azanyl-3-(2-methylsulfanyl-1,3-thiazol-5-yl)-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: benzhydryl 7-amino-3-(2-methylsulfanylthiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 7-amino-3-[2-(methylthio)-5-thiazolyl]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-amino-3-(2-methylsulfanyl-1,3-thiazol-5-yl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 7-amino-8-keto-3-[2-(methylthio)thiazol-5-yl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester Formula: C24H21N3O3S3 MolecularWeight: 495.63684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(S1)C2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CSC1=NC=C(S1)C2=C(N3C(C(C3=O)N)SC2)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H21N3O3S3/c1-31-24-26-12-17(33-24)16-13-32-22-18(25)21(28)27(22)19(16)23(29)30-20(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-12,18,20,22H,13,25H2,1H3