methyl (3S)-3-phenyl-3-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]propanoate

Systemtic Name: methyl (3S)-3-phenyl-3-[2-(thiophen-2-ylcarbonylamino)ethanoylamino]propanoate Openeye Name: methyl (3S)-3-phenyl-3-[[2-(thiophene-2-carbonylamino)acetyl]amino]propanoate CAS Name: (3S)-3-[[1-oxo-2-[[oxo(thiophen-2-yl)methyl]amino]ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-phenyl-3-[[2-(thiophene-2-carbonylamino)acetyl]amino]propanoate Traditional Name: (3S)-3-phenyl-3-[[2-(2-thenoylamino)acetyl]amino]propionic acid methyl ester Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=CS2

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)CNC(=O)C2=CC=CS2

InChI

InChI=1S/C17H18N2O4S/c1-23-16(21)10-13(12-6-3-2-4-7-12)19-15(20)11-18-17(22)14-8-5-9-24-14/h2-9,13H,10-11H2,1H3,(H,18,22)(H,19,20)/t13-/m0/s1