diethylamino 2-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)imidazole-4-carboxylate

Systemtic Name: diethylamino 2-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)imidazole-4-carboxylate Openeye Name: diethylamino 2-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)imidazole-4-carboxylate CAS Name: 2-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)-4-imidazolecarboxylic acid diethylamino ester IUPAC Name: diethylamino 2-(4-chlorophenyl)-1-(4-methylsulfonylphenyl)imidazole-4-carboxylate Traditional Name: 2-(4-chlorophenyl)-1-(4-mesylphenyl)imidazole-4-carboxylic acid diethylamino ester Formula: C21H22ClN3O4S MolecularWeight: 447.93508

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)OC(=O)C1=CN(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCN(CC)OC(=O)C1=CN(C(=N1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C21H22ClN3O4S/c1-4-24(5-2)29-21(26)19-14-25(17-10-12-18(13-11-17)30(3,27)28)20(23-19)15-6-8-16(22)9-7-15/h6-14H,4-5H2,1-3H3