(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-methylsulfanyl-3-nitro-phenyl)carbonylbenzoate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-methylsulfanyl-3-nitro-phenyl)carbonylbenzoate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 2-(4-methylsulfanyl-3-nitro-benzoyl)benzoate CAS Name: 2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzoic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(4-methylsulfanyl-3-nitrobenzoyl)benzoate Traditional Name: 2-[4-(methylthio)-3-nitro-benzoyl]benzoic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C23H16N2O6S2 MolecularWeight: 480.51294

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=COC(=N3)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC3=COC(=N3)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N2O6S2/c1-32-19-9-8-14(11-18(19)25(28)29)21(26)16-5-2-3-6-17(16)23(27)31-13-15-12-30-22(24-15)20-7-4-10-33-20/h2-12H,13H2,1H3