ethyl 2-[2-(2-benzamidoethanoyloxy)ethanoylamino]-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-benzamidoethanoyloxy)ethanoylamino]-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-benzamidoacetyl)oxyacetyl]amino]-4-isobutyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2-benzamido-1-oxoethoxy)-1-oxoethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-benzamidoacetyl)oxyacetyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 2-[(2-hippuroyloxyacetyl)amino]-4-isobutyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)CNC(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(SC=C1CC(C)C)NC(=O)COC(=O)CNC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O6S/c1-4-29-22(28)19-16(10-14(2)3)13-31-21(19)24-17(25)12-30-18(26)11-23-20(27)15-8-6-5-7-9-15/h5-9,13-14H,4,10-12H2,1-3H3,(H,23,27)(H,24,25)