(phenylmethyl) (2S)-3-methyl-2-(2-thiophen-3-ylethanoylamino)butanoate

Systemtic Name: (phenylmethyl) (2S)-3-methyl-2-(2-thiophen-3-ylethanoylamino)butanoate Openeye Name: benzyl (2S)-3-methyl-2-[[2-(3-thienyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[1-oxo-2-(3-thiophenyl)ethyl]amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-methyl-2-[(2-thiophen-3-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(3-thienyl)acetyl]amino]butyric acid benzyl ester Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)CC2=CSC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)CC2=CSC=C2

InChI

InChI=1S/C18H21NO3S/c1-13(2)17(19-16(20)10-15-8-9-23-12-15)18(21)22-11-14-6-4-3-5-7-14/h3-9,12-13,17H,10-11H2,1-2H3,(H,19,20)/t17-/m0/s1