ethyl 2-[2-(2-phenyl-2-phenylsulfanyl-ethanoyl)oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-phenyl-2-phenylsulfanyl-ethanoyl)oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-phenyl-2-phenylsulfanyl-acetyl)oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[1-oxo-2-phenyl-2-(phenylthio)ethoxy]ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-phenyl-2-phenylsulfanylacetyl)oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[2-phenyl-2-(phenylthio)acetyl]oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C27H27NO5S2 MolecularWeight: 509.63698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C(C3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C27H27NO5S2/c1-2-32-26(30)23-20-15-9-10-16-21(20)35-25(23)28-22(29)17-33-27(31)24(18-11-5-3-6-12-18)34-19-13-7-4-8-14-19/h3-8,11-14,24H,2,9-10,15-17H2,1H3,(H,28,29)