(2S)-2-[2-(4-methoxyphenyl)ethanethioylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[2-(4-methoxyphenyl)ethanethioylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(4-methoxyphenyl)ethanethioyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-(4-methoxyphenyl)-1-sulfanylideneethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-(4-methoxyphenyl)ethanethioyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(4-methoxyphenyl)thioacetyl]amino]-3-phenyl-propionic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=S)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)CC(=S)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H19NO3S/c1-22-15-9-7-14(8-10-15)12-17(23)19-16(18(20)21)11-13-5-3-2-4-6-13/h2-10,16H,11-12H2,1H3,(H,19,23)(H,20,21)/t16-/m0/s1