methyl 3-(3,4-dimethoxyphenyl)-3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate

Systemtic Name: methyl 3-(3,4-dimethoxyphenyl)-3-[3-(thiophen-3-ylcarbonylamino)propanoylamino]propanoate Openeye Name: methyl 3-(3,4-dimethoxyphenyl)-3-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate CAS Name: 3-(3,4-dimethoxyphenyl)-3-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dimethoxyphenyl)-3-[3-(thiophene-3-carbonylamino)propanoylamino]propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)-3-[3-(3-thenoylamino)propanoylamino]propionic acid methyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)CCNC(=O)C2=CSC=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CC(=O)OC)NC(=O)CCNC(=O)C2=CSC=C2)OC

InChI

InChI=1S/C20H24N2O6S/c1-26-16-5-4-13(10-17(16)27-2)15(11-19(24)28-3)22-18(23)6-8-21-20(25)14-7-9-29-12-14/h4-5,7,9-10,12,15H,6,8,11H2,1-3H3,(H,21,25)(H,22,23)