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

Systemtic Name: methyl 3-[3-(4-tert-butylphenyl)propanoylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[3-(4-tert-butylphenyl)propanoylamino]-3-(2-thienyl)propanoate CAS Name: 3-[[3-(4-tert-butylphenyl)-1-oxopropyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(4-tert-butylphenyl)propanoylamino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[3-(4-tert-butylphenyl)propanoylamino]-3-(2-thienyl)propionic acid methyl ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NC(CC(=O)OC)C2=CC=CS2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CCC(=O)NC(CC(=O)OC)C2=CC=CS2

InChI

InChI=1S/C21H27NO3S/c1-21(2,3)16-10-7-15(8-11-16)9-12-19(23)22-17(14-20(24)25-4)18-6-5-13-26-18/h5-8,10-11,13,17H,9,12,14H2,1-4H3,(H,22,23)