(2R)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanylpropanoate

Systemtic Name: (2R)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]propanoate IUPAC Name: (2R)-2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]propionate Formula: C14H15N2O3S- MolecularWeight: 291.3455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])SC1=NC(=CN1CC2=CC=CC=C2)CO

Isomeric SMILES

C[C@H](C(=O)[O-])SC1=NC(=CN1CC2=CC=CC=C2)CO

InChI

InChI=1S/C14H16N2O3S/c1-10(13(18)19)20-14-15-12(9-17)8-16(14)7-11-5-3-2-4-6-11/h2-6,8,10,17H,7,9H2,1H3,(H,18,19)/p-1/t10-/m1/s1