ethyl 2-[(4-oxidanylidene-4-phenethyloxy-butanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-oxidanylidene-4-phenethyloxy-butanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(4-oxo-4-phenethyloxy-butanoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(1,4-dioxo-4-phenethyloxybutyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-oxo-4-phenethyloxybutanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(4-keto-4-phenethyloxy-butanoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C23H27NO5S MolecularWeight: 429.52918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CCC(=O)OCCC3=CC=CC=C3

InChI

InChI=1S/C23H27NO5S/c1-2-28-23(27)21-17-10-6-7-11-18(17)30-22(21)24-19(25)12-13-20(26)29-15-14-16-8-4-3-5-9-16/h3-5,8-9H,2,6-7,10-15H2,1H3,(H,24,25)