methyl (3S)-3-(4-bromophenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate

Systemtic Name: methyl (3S)-3-(4-bromophenyl)-3-(2-thiophen-2-ylethanoylamino)propanoate Openeye Name: methyl (3S)-3-(4-bromophenyl)-3-[[2-(2-thienyl)acetyl]amino]propanoate CAS Name: (3S)-3-(4-bromophenyl)-3-[(1-oxo-2-thiophen-2-ylethyl)amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(4-bromophenyl)-3-[(2-thiophen-2-ylacetyl)amino]propanoate Traditional Name: (3S)-3-(4-bromophenyl)-3-[[2-(2-thienyl)acetyl]amino]propionic acid methyl ester Formula: C16H16BrNO3S MolecularWeight: 382.27214

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)Br)NC(=O)CC2=CC=CS2

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=C(C=C1)Br)NC(=O)CC2=CC=CS2

InChI

InChI=1S/C16H16BrNO3S/c1-21-16(20)10-14(11-4-6-12(17)7-5-11)18-15(19)9-13-3-2-8-22-13/h2-8,14H,9-10H2,1H3,(H,18,19)/t14-/m0/s1