ethyl 2-(dibenzofuran-2-ylcarbonylamino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-(dibenzofuran-2-ylcarbonylamino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-(dibenzofuran-2-carbonylamino)-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-dibenzofuranyl(oxo)methyl]amino]-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(dibenzofuran-2-carbonylamino)-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-(dibenzofuran-2-carbonylamino)-6-ethyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C26H25NO4S MolecularWeight: 447.546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3=CC4=C(C=C3)OC5=CC=CC=C54

InChI

InChI=1S/C26H25NO4S/c1-3-15-9-11-18-22(13-15)32-25(23(18)26(29)30-4-2)27-24(28)16-10-12-21-19(14-16)17-7-5-6-8-20(17)31-21/h5-8,10,12,14-15H,3-4,9,11,13H2,1-2H3,(H,27,28)