ethyl 5-[(4-iodophenyl)carbonylamino]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: ethyl 5-[(4-iodophenyl)carbonylamino]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: ethyl 5-[(4-iodobenzoyl)amino]-2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 5-[[(4-iodophenyl)-oxomethyl]amino]-2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-iodobenzoyl)amino]-2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 5-[(4-iodobenzoyl)amino]-2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid ethyl ester Formula: C20H18IN3O3S MolecularWeight: 507.34469

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1C2=CC=CC=C2)SC)NC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1C2=CC=CC=C2)SC)NC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C20H18IN3O3S/c1-3-27-19(26)16-17(22-18(25)13-9-11-14(21)12-10-13)23-20(28-2)24(16)15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H,22,25)