methyl 3-[3-(2-phenylethanoylamino)propanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[3-(2-phenylethanoylamino)propanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[3-[(2-phenylacetyl)amino]propanoylamino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-3-[(1-oxo-2-phenylethyl)amino]propyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[3-[(2-phenylacetyl)amino]propanoylamino]thiophene-2-carboxylate Traditional Name: 3-[3-[(2-phenylacetyl)amino]propanoylamino]thiophene-2-carboxylic acid methyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CCNC(=O)CC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CCNC(=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O4S/c1-23-17(22)16-13(8-10-24-16)19-14(20)7-9-18-15(21)11-12-5-3-2-4-6-12/h2-6,8,10H,7,9,11H2,1H3,(H,18,21)(H,19,20)