methyl 3-(4-phenylbutanoylamino)-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-(4-phenylbutanoylamino)-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-(4-phenylbutanoylamino)-3-(2-thienyl)propanoate CAS Name: 3-[(1-oxo-4-phenylbutyl)amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-(4-phenylbutanoylamino)-3-thiophen-2-ylpropanoate Traditional Name: 3-(4-phenylbutanoylamino)-3-(2-thienyl)propionic acid methyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CCCC2=CC=CC=C2

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)CCCC2=CC=CC=C2

InChI

InChI=1S/C18H21NO3S/c1-22-18(21)13-15(16-10-6-12-23-16)19-17(20)11-5-9-14-7-3-2-4-8-14/h2-4,6-8,10,12,15H,5,9,11,13H2,1H3,(H,19,20)