[2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate

Systemtic Name: [2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl] 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate Openeye Name: [2-[(4-bromophenyl)methyl-methyl-amino]-2-oxo-ethyl] 3-(4-fluorophenyl)-2-methylsulfanyl-imidazole-4-carboxylate CAS Name: 3-(4-fluorophenyl)-2-(methylthio)-4-imidazolecarboxylic acid [2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl] 3-(4-fluorophenyl)-2-methylsulfanylimidazole-4-carboxylate Traditional Name: 3-(4-fluorophenyl)-2-(methylthio)imidazole-4-carboxylic acid [2-[(4-bromobenzyl)-methyl-amino]-2-keto-ethyl] ester Formula: C21H19BrFN3O3S MolecularWeight: 492.361263

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)C(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)C(=O)COC(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C21H19BrFN3O3S/c1-25(12-14-3-5-15(22)6-4-14)19(27)13-29-20(28)18-11-24-21(30-2)26(18)17-9-7-16(23)8-10-17/h3-11H,12-13H2,1-2H3