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

Systemtic Name: ethyl 2-[[5-(hydroxymethyl)-1-(pyridin-4-ylmethyl)imidazol-2-yl]sulfanylmethyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[5-(hydroxymethyl)-1-(4-pyridylmethyl)imidazol-2-yl]sulfanylmethyl]thiazole-4-carboxylate CAS Name: 2-[[[5-(hydroxymethyl)-1-(pyridin-4-ylmethyl)-2-imidazolyl]thio]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-(hydroxymethyl)-1-(pyridin-4-ylmethyl)imidazol-2-yl]sulfanylmethyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[[5-methylol-1-(4-pyridylmethyl)imidazol-2-yl]thio]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H18N4O3S2 MolecularWeight: 390.47982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CSC2=NC=C(N2CC3=CC=NC=C3)CO

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CSC2=NC=C(N2CC3=CC=NC=C3)CO

InChI

InChI=1S/C17H18N4O3S2/c1-2-24-16(23)14-10-25-15(20-14)11-26-17-19-7-13(9-22)21(17)8-12-3-5-18-6-4-12/h3-7,10,22H,2,8-9,11H2,1H3