ethyl 4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-phenyl-thiazole-5-carboxylate CAS Name: 4-[[(1-methyl-2-imidazolyl)thio]methyl]-2-phenyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1-methylimidazol-2-yl)sulfanylmethyl]-2-phenyl-1,3-thiazole-5-carboxylate Traditional Name: 4-[[(1-methylimidazol-2-yl)thio]methyl]-2-phenyl-thiazole-5-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(S1)C2=CC=CC=C2)CSC3=NC=CN3C

Isomeric SMILES

CCOC(=O)C1=C(N=C(S1)C2=CC=CC=C2)CSC3=NC=CN3C

InChI

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