3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-2-methylsulfanyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-(methylthio)imidazole-4-carboxamide Formula: C20H20FN5O5S2 MolecularWeight: 493.531703

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CSC1=NC=C(N1C2=CC=C(C=C2)F)C(=O)NCCNC3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20FN5O5S2/c1-32-20-24-12-18(25(20)14-5-3-13(21)4-6-14)19(27)23-10-9-22-16-8-7-15(33(2,30)31)11-17(16)26(28)29/h3-8,11-12,22H,9-10H2,1-2H3,(H,23,27)