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

Systemtic Name: (2R)-2-[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanylpropanoate Openeye Name: (2R)-2-[4-(hydroxymethyl)-1-(p-tolylmethyl)imidazol-2-yl]sulfanylpropanoate CAS Name: (2R)-2-[[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]-2-imidazolyl]thio]propanoate IUPAC Name: (2R)-2-[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanylpropanoate Traditional Name: (2R)-2-[[1-(4-methylbenzyl)-4-methylol-imidazol-2-yl]thio]propionate Formula: C15H17N2O3S- MolecularWeight: 305.37208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(N=C2SC(C)C(=O)[O-])CO

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(N=C2S[C@H](C)C(=O)[O-])CO

InChI

InChI=1S/C15H18N2O3S/c1-10-3-5-12(6-4-10)7-17-8-13(9-18)16-15(17)21-11(2)14(19)20/h3-6,8,11,18H,7,9H2,1-2H3,(H,19,20)/p-1/t11-/m1/s1