ethyl 2-[2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoyloxy]ethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoyloxy]ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-oxoethoxy]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]acetyl]oxyacetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H21ClN2O6S2 MolecularWeight: 508.99494

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)OCC

InChI

InChI=1S/C22H21ClN2O6S2/c1-3-12-9-14(22(29)30-4-2)21(32-12)25-16(26)11-31-17(27)10-24-20(28)19-18(23)13-7-5-6-8-15(13)33-19/h5-9H,3-4,10-11H2,1-2H3,(H,24,28)(H,25,26)