methyl 4-[2-[(2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoyl]oxyethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(2R)-3-methyl-2-(thiophen-2-ylcarbonylamino)butanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(2R)-3-methyl-1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]butoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(2R)-3-methyl-2-(thiophene-2-carbonylamino)butanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(2R)-3-methyl-2-(2-thenoylamino)butanoyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NC1=CC=C(C=C1)C(=O)OC)NC(=O)C2=CC=CS2

InChI

InChI=1S/C20H22N2O6S/c1-12(2)17(22-18(24)15-5-4-10-29-15)20(26)28-11-16(23)21-14-8-6-13(7-9-14)19(25)27-3/h4-10,12,17H,11H2,1-3H3,(H,21,23)(H,22,24)/t17-/m1/s1