ethyl 4-phenyl-2-[2-(2-phenyl-2-phenylsulfanyl-ethanoyl)oxyethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[2-(2-phenyl-2-phenylsulfanyl-ethanoyl)oxyethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[2-(2-phenyl-2-phenylsulfanyl-acetyl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[1-oxo-2-phenyl-2-(phenylthio)ethoxy]ethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[[2-(2-phenyl-2-phenylsulfanylacetyl)oxyacetyl]amino]thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[2-[2-phenyl-2-(phenylthio)acetyl]oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C29H25NO5S2 MolecularWeight: 531.6425

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)COC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C29H25NO5S2/c1-2-34-28(32)25-23(20-12-6-3-7-13-20)19-36-27(25)30-24(31)18-35-29(33)26(21-14-8-4-9-15-21)37-22-16-10-5-11-17-22/h3-17,19,26H,2,18H2,1H3,(H,30,31)