ethyl 2-[[5-(hydroxymethyl)-1-phenethyl-imidazol-2-yl]sulfanylmethyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[5-(hydroxymethyl)-1-phenethyl-imidazol-2-yl]sulfanylmethyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[5-(hydroxymethyl)-1-phenethyl-imidazol-2-yl]sulfanylmethyl]thiazole-4-carboxylate CAS Name: 2-[[[5-(hydroxymethyl)-1-phenethyl-2-imidazolyl]thio]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(hydroxymethyl)-1-phenethylimidazol-2-yl]sulfanylmethyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(5-methylol-1-phenethyl-imidazol-2-yl)thio]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CSC2=NC=C(N2CCC3=CC=CC=C3)CO

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CSC2=NC=C(N2CCC3=CC=CC=C3)CO

InChI

InChI=1S/C19H21N3O3S2/c1-2-25-18(24)16-12-26-17(21-16)13-27-19-20-10-15(11-23)22(19)9-8-14-6-4-3-5-7-14/h3-7,10,12,23H,2,8-9,11,13H2,1H3