ethyl 1-(4-methyl-1,3-thiazol-2-yl)-5-(phenylmethylsulfanyl)imidazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methyl-1,3-thiazol-2-yl)-5-(phenylmethylsulfanyl)imidazole-4-carboxylate Openeye Name: ethyl 5-benzylsulfanyl-1-(4-methylthiazol-2-yl)imidazole-4-carboxylate CAS Name: 1-(4-methyl-2-thiazolyl)-5-(phenylmethylthio)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-benzylsulfanyl-1-(4-methyl-1,3-thiazol-2-yl)imidazole-4-carboxylate Traditional Name: 5-(benzylthio)-1-(4-methylthiazol-2-yl)imidazole-4-carboxylic acid ethyl ester Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C=N1)C2=NC(=CS2)C)SCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(N(C=N1)C2=NC(=CS2)C)SCC3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S2/c1-3-22-16(21)14-15(23-10-13-7-5-4-6-8-13)20(11-18-14)17-19-12(2)9-24-17/h4-9,11H,3,10H2,1-2H3