3-azanyl-5-(phenylmethylsulfanyl)pentanoic acid

Systemtic Name: 3-azanyl-5-(phenylmethylsulfanyl)pentanoic acid Openeye Name: 3-amino-5-benzylsulfanyl-pentanoic acid CAS Name: 3-amino-5-(phenylmethylthio)pentanoic acid IUPAC Name: 3-amino-5-benzylsulfanylpentanoic acid Traditional Name: 3-amino-5-(benzylthio)valeric acid Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO2S/c13-11(8-12(14)15)6-7-16-9-10-4-2-1-3-5-10/h1-5,11H,6-9,13H2,(H,14,15)