2-[[(2S)-3-phenyl-2-(4-sulfanylimidazol-1-yl)propanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-3-phenyl-2-(4-sulfanylimidazol-1-yl)propanoyl]amino]ethanoic acid Openeye Name: 2-[[(2S)-3-phenyl-2-(4-sulfanylimidazol-1-yl)propanoyl]amino]acetic acid CAS Name: 2-[[(2S)-2-(4-mercapto-1-imidazolyl)-1-oxo-3-phenylpropyl]amino]acetic acid IUPAC Name: 2-[[(2S)-3-phenyl-2-(4-sulfanylimidazol-1-yl)propanoyl]amino]acetic acid Traditional Name: 2-[[(2S)-2-(4-mercaptoimidazol-1-yl)-3-phenyl-propanoyl]amino]acetic acid Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCC(=O)O)N2C=C(N=C2)S

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)NCC(=O)O)N2C=C(N=C2)S

InChI

InChI=1S/C14H15N3O3S/c18-13(19)7-15-14(20)11(17-8-12(21)16-9-17)6-10-4-2-1-3-5-10/h1-5,8-9,11,21H,6-7H2,(H,15,20)(H,18,19)/t11-/m0/s1