ethyl 5-acetamido-2-methylsulfanyl-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate

Systemtic Name: ethyl 5-acetamido-2-methylsulfanyl-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate Openeye Name: ethyl 5-acetamido-2-methylsulfanyl-3-(2-thienylmethyl)imidazole-4-carboxylate CAS Name: 5-acetamido-2-(methylthio)-3-(thiophen-2-ylmethyl)-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetamido-2-methylsulfanyl-3-(thiophen-2-ylmethyl)imidazole-4-carboxylate Traditional Name: 5-acetamido-2-(methylthio)-3-(2-thenyl)imidazole-4-carboxylic acid ethyl ester Formula: C14H17N3O3S2 MolecularWeight: 339.43308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1CC2=CC=CS2)SC)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1CC2=CC=CS2)SC)NC(=O)C

InChI

InChI=1S/C14H17N3O3S2/c1-4-20-13(19)11-12(15-9(2)18)16-14(21-3)17(11)8-10-6-5-7-22-10/h5-7H,4,8H2,1-3H3,(H,15,18)