2-azanyl-3-oxidanylidene-3-phenyl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid

Systemtic Name: 2-azanyl-3-oxidanylidene-3-phenyl-2-[[2-(phenylmethyl)-3-sulfanyl-propanoyl]amino]propanoic acid Openeye Name: 2-amino-2-[(2-benzyl-3-sulfanyl-propanoyl)amino]-3-oxo-3-phenyl-propanoic acid CAS Name: 2-amino-2-[[2-(mercaptomethyl)-1-oxo-3-phenylpropyl]amino]-3-oxo-3-phenylpropanoic acid IUPAC Name: 2-amino-2-[(2-benzyl-3-sulfanylpropanoyl)amino]-3-oxo-3-phenylpropanoic acid Traditional Name: 2-amino-2-[(2-benzyl-3-mercapto-propanoyl)amino]-3-keto-3-phenyl-propionic acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CS)C(=O)NC(C(=O)C2=CC=CC=C2)(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CC(CS)C(=O)NC(C(=O)C2=CC=CC=C2)(C(=O)O)N

InChI

InChI=1S/C19H20N2O4S/c20-19(18(24)25,16(22)14-9-5-2-6-10-14)21-17(23)15(12-26)11-13-7-3-1-4-8-13/h1-10,15,26H,11-12,20H2,(H,21,23)(H,24,25)