2-acetamido-3-nitroso-3-(phenylmethyl)-4-(3-sulfanylphenyl)butanoic acid

Systemtic Name: 2-acetamido-3-nitroso-3-(phenylmethyl)-4-(3-sulfanylphenyl)butanoic acid Openeye Name: 2-acetamido-3-benzyl-3-nitroso-4-(3-sulfanylphenyl)butanoic acid CAS Name: 2-acetamido-3-[(3-mercaptophenyl)methyl]-3-nitroso-4-phenylbutanoic acid IUPAC Name: 2-acetamido-3-benzyl-3-nitroso-4-(3-sulfanylphenyl)butanoic acid Traditional Name: 2-acetamido-3-benzyl-4-(3-mercaptophenyl)-3-nitroso-butyric acid Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O4S/c1-13(22)20-17(18(23)24)19(21-25,11-14-6-3-2-4-7-14)12-15-8-5-9-16(26)10-15/h2-10,17,26H,11-12H2,1H3,(H,20,22)(H,23,24)