3-[2-[[2-(diphenylmethyl)oxycarbonyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]sulfanyl]-1,3-thiazol-4-yl]propanoic acid

Systemtic Name: 3-[2-[[2-(diphenylmethyl)oxycarbonyl-8-oxidanylidene-7-(2-thiophen-2-ylethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]sulfanyl]-1,3-thiazol-4-yl]propanoic acid Openeye Name: 3-[2-[[2-benzhydryloxycarbonyl-8-oxo-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]sulfanyl]thiazol-4-yl]propanoic acid CAS Name: 3-[2-[[2-[(diphenylmethyl)oxy-oxomethyl]-8-oxo-7-[(1-oxo-2-thiophen-2-ylethyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]-4-thiazolyl]propanoic acid IUPAC Name: 3-[2-[[2-benzhydryloxycarbonyl-8-oxo-7-[(2-thiophen-2-ylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]sulfanyl]-1,3-thiazol-4-yl]propanoic acid Traditional Name: 3-[2-[[2-benzhydryloxycarbonyl-8-keto-7-[[2-(2-thienyl)acetyl]amino]-5-thia-1-azabicyclo[4.2.0]oct-2-en-3-yl]thio]thiazol-4-yl]propionic acid Formula: C32H27N3O6S4 MolecularWeight: 677.83328

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC(=CS6)CCC(=O)O

Isomeric SMILES

C1C(=C(N2C(S1)C(C2=O)NC(=O)CC3=CC=CS3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5)SC6=NC(=CS6)CCC(=O)O

InChI

InChI=1S/C32H27N3O6S4/c36-24(16-22-12-7-15-42-22)34-26-29(39)35-27(23(18-43-30(26)35)45-32-33-21(17-44-32)13-14-25(37)38)31(40)41-28(19-8-3-1-4-9-19)20-10-5-2-6-11-20/h1-12,15,17,26,28,30H,13-14,16,18H2,(H,34,36)(H,37,38)