2-azanyl-3,3-dideuterio-3-(phenylmethylsulfanyl)propanoic acid

Systemtic Name: 2-azanyl-3,3-dideuterio-3-(phenylmethylsulfanyl)propanoic acid Openeye Name: 2-amino-3-benzylsulfanyl-3,3-dideuterio-propanoic acid CAS Name: 2-amino-3,3-dideuterio-3-(phenylmethylthio)propanoic acid IUPAC Name: 2-amino-3-benzylsulfanyl-3,3-dideuteriopropanoic acid Traditional Name: 2-amino-3-(benzylthio)-3,3-dideuterio-propionic acid Formula: C10H13NO2S MolecularWeight: 213.293044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])(C(C(=O)O)N)SCC1=CC=CC=C1

InChI

InChI=1S/C10H13NO2S/c11-9(10(12)13)7-14-6-8-4-2-1-3-5-8/h1-5,9H,6-7,11H2,(H,12,13)/i7D2