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2-azanyl-3-oxidanylidene-2-(phenylmethyl)-5-sulfanyl-pentanoic acid

2-azanyl-3-oxidanylidene-2-(phenylmethyl)-5-sulfanyl-pentanoic acid

Systemtic Name:2-azanyl-3-oxidanylidene-2-(phenylmethyl)-5-sulfanyl-pentanoic acid
Openeye Name:2-amino-2-benzyl-3-oxo-5-sulfanyl-pentanoic acid
CAS Name:2-amino-5-mercapto-3-oxo-2-(phenylmethyl)pentanoic acid
IUPAC Name:2-amino-2-benzyl-3-oxo-5-sulfanylpentanoic acid
Traditional Name:2-amino-2-benzyl-3-keto-5-mercapto-valeric acid
Formula: C12H15NO3S
MolecularWeight: 253.3174
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H15NO3S/c13-12(11(15)16,10(14)6-7-17)8-9-4-2-1-3-5-9/h1-5,17H,6-8,13H2,(H,15,16)


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