4-azanyl-4-oxidanylidene-2-(phenylmethylsulfanyl)butanoic acid

Systemtic Name: 4-azanyl-4-oxidanylidene-2-(phenylmethylsulfanyl)butanoic acid Openeye Name: 4-amino-2-benzylsulfanyl-4-oxo-butanoic acid CAS Name: 4-amino-4-oxo-2-(phenylmethylthio)butanoic acid IUPAC Name: 4-amino-2-benzylsulfanyl-4-oxobutanoic acid Traditional Name: 4-amino-2-(benzylthio)-4-keto-butyric acid Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC(CC(=O)N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CSC(CC(=O)N)C(=O)O

InChI

InChI=1S/C11H13NO3S/c12-10(13)6-9(11(14)15)16-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,12,13)(H,14,15)