(2S)-2-[2-(2,5-dimethylphenyl)ethanethioylamino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[2-(2,5-dimethylphenyl)ethanethioylamino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(2,5-dimethylphenyl)ethanethioyl]amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-(2,5-dimethylphenyl)-1-sulfanylideneethyl]amino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[[2-(2,5-dimethylphenyl)ethanethioyl]amino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-(2,5-dimethylphenyl)thioacetyl]amino]-3-phenyl-propionic acid Formula: C19H21NO2S MolecularWeight: 327.44054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC(=S)NC(CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC(=S)N[C@@H](CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C19H21NO2S/c1-13-8-9-14(2)16(10-13)12-18(23)20-17(19(21)22)11-15-6-4-3-5-7-15/h3-10,17H,11-12H2,1-2H3,(H,20,23)(H,21,22)/t17-/m0/s1