prop-2-enyl 8-oxidanylidene-3-[[2-(4-oxidanylidene-1H-quinazolin-2-yl)phenoxy]methyl]-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate

Systemtic Name: prop-2-enyl 8-oxidanylidene-3-[[2-(4-oxidanylidene-1H-quinazolin-2-yl)phenoxy]methyl]-7-(2-phenoxyethanoylamino)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Openeye Name: allyl 8-oxo-3-[[2-(4-oxo-1H-quinazolin-2-yl)phenoxy]methyl]-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate CAS Name: 8-oxo-7-[(1-oxo-2-phenoxyethyl)amino]-3-[[2-(4-oxo-1H-quinazolin-2-yl)phenoxy]methyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 8-oxo-3-[[2-(4-oxo-1H-quinazolin-2-yl)phenoxy]methyl]-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate Traditional Name: 8-keto-3-[[2-(4-keto-1H-quinazolin-2-yl)phenoxy]methyl]-7-[(2-phenoxyacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid allyl ester Formula: C33H28N4O7S MolecularWeight: 624.66302

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C1=C(CSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3)COC4=CC=CC=C4C5=NC(=O)C6=CC=CC=C6N5

Isomeric SMILES

C=CCOC(=O)C1=C(CSC2N1C(=O)C2NC(=O)COC3=CC=CC=C3)COC4=CC=CC=C4C5=NC(=O)C6=CC=CC=C6N5

InChI

InChI=1S/C33H28N4O7S/c1-2-16-42-33(41)28-20(19-45-32-27(31(40)37(28)32)35-26(38)18-43-21-10-4-3-5-11-21)17-44-25-15-9-7-13-23(25)29-34-24-14-8-6-12-22(24)30(39)36-29/h2-15,27,32H,1,16-19H2,(H,35,38)(H,34,36,39)