3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-N-[(2-nitrophenyl)methyl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-N-[(2-nitrophenyl)methyl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-N-[(2-nitrophenyl)methyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-methyl-2-(methylthio)-N-[(2-nitrophenyl)methyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-methyl-2-methylsulfanyl-N-[(2-nitrophenyl)methyl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-methyl-2-(methylthio)-N-(2-nitrobenzyl)imidazole-4-carboxamide Formula: C19H17FN4O3S MolecularWeight: 400.426683

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

Isomeric SMILES

CN(CC1=CC=CC=C1[N+](=O)[O-])C(=O)C2=CN=C(N2C3=CC=C(C=C3)F)SC

InChI

InChI=1S/C19H17FN4O3S/c1-22(12-13-5-3-4-6-16(13)24(26)27)18(25)17-11-21-19(28-2)23(17)15-9-7-14(20)8-10-15/h3-11H,12H2,1-2H3