(diphenylmethyl) 7-(cyclohexylcarbonylamino)-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate

Systemtic Name: (diphenylmethyl) 7-(cyclohexylcarbonylamino)-3-methylidene-8-oxidanylidene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Openeye Name: benzhydryl 7-(cyclohexanecarbonylamino)-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate CAS Name: 7-[[cyclohexyl(oxo)methyl]amino]-3-methylene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 7-(cyclohexanecarbonylamino)-3-methylidene-8-oxo-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylate Traditional Name: 7-(cyclohexanecarbonylamino)-8-keto-3-methylene-5-thia-1-azabicyclo[4.2.0]octane-2-carboxylic acid benzhydryl ester Formula: C28H30N2O4S MolecularWeight: 490.6138

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Descriptors Computed from Structure

Canonical SMILES:

C=C1CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5CCCCC5

Isomeric SMILES

C=C1CSC2C(C(=O)N2C1C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)C5CCCCC5

InChI

InChI=1S/C28H30N2O4S/c1-18-17-35-27-22(29-25(31)21-15-9-4-10-16-21)26(32)30(27)23(18)28(33)34-24(19-11-5-2-6-12-19)20-13-7-3-8-14-20/h2-3,5-8,11-14,21-24,27H,1,4,9-10,15-17H2,(H,29,31)