ethyl 1-methyl-4-[2-[4-(trifluoromethyl)phenyl]sulfanylethoxycarbonylamino]imidazole-2-carboxylate

Systemtic Name: ethyl 1-methyl-4-[2-[4-(trifluoromethyl)phenyl]sulfanylethoxycarbonylamino]imidazole-2-carboxylate Openeye Name: ethyl 1-methyl-4-[2-[4-(trifluoromethyl)phenyl]sulfanylethoxycarbonylamino]imidazole-2-carboxylate CAS Name: 1-methyl-4-[[oxo-[2-[[4-(trifluoromethyl)phenyl]thio]ethoxy]methyl]amino]-2-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-methyl-4-[2-[4-(trifluoromethyl)phenyl]sulfanylethoxycarbonylamino]imidazole-2-carboxylate Traditional Name: 1-methyl-4-[2-[[4-(trifluoromethyl)phenyl]thio]ethoxycarbonylamino]imidazole-2-carboxylic acid ethyl ester Formula: C17H18F3N3O4S MolecularWeight: 417.40273

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=CN1C)NC(=O)OCCSC2=CC=C(C=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=NC(=CN1C)NC(=O)OCCSC2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3N3O4S/c1-3-26-15(24)14-21-13(10-23(14)2)22-16(25)27-8-9-28-12-6-4-11(5-7-12)17(18,19)20/h4-7,10H,3,8-9H2,1-2H3,(H,22,25)