methyl 3-[3-(4-cyanophenyl)propanoylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[3-(4-cyanophenyl)propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[3-(4-cyanophenyl)propanoylamino]-3-(2-thienyl)propanoate CAS Name: 3-[[3-(4-cyanophenyl)-1-oxopropyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-cyanophenyl)propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[3-(4-cyanophenyl)propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)CCC2=CC=C(C=C2)C#N

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)CCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H18N2O3S/c1-23-18(22)11-15(16-3-2-10-24-16)20-17(21)9-8-13-4-6-14(12-19)7-5-13/h2-7,10,15H,8-9,11H2,1H3,(H,20,21)