ethyl 5-ethyl-2-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[2-[2-[(phenylmethyl)carbamoylamino]ethanoyloxy]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-2-[1-oxo-2-[[oxo-[(phenylmethyl)amino]methyl]amino]ethoxy]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-[2-(benzylcarbamoylamino)acetyl]oxyacetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)COC(=O)CNC(=O)NCC2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C21H25N3O6S/c1-3-15-10-16(20(27)29-4-2)19(31-15)24-17(25)13-30-18(26)12-23-21(28)22-11-14-8-6-5-7-9-14/h5-10H,3-4,11-13H2,1-2H3,(H,24,25)(H2,22,23,28)