N-(4-fluoranyl-2-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide

Systemtic Name: N-(4-fluoranyl-2-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-phenyl)carbonyl-benzamide Openeye Name: N-(4-fluoro-2-methyl-phenyl)-2-(4-methylsulfanyl-3-nitro-benzoyl)benzamide CAS Name: N-(4-fluoro-2-methylphenyl)-2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]benzamide IUPAC Name: N-(4-fluoro-2-methylphenyl)-2-(4-methylsulfanyl-3-nitrobenzoyl)benzamide Traditional Name: N-(4-fluoro-2-methyl-phenyl)-2-[4-(methylthio)-3-nitro-benzoyl]benzamide Formula: C22H17FN2O4S MolecularWeight: 424.444783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)F)NC(=O)C2=CC=CC=C2C(=O)C3=CC(=C(C=C3)SC)[N+](=O)[O-]

InChI

InChI=1S/C22H17FN2O4S/c1-13-11-15(23)8-9-18(13)24-22(27)17-6-4-3-5-16(17)21(26)14-7-10-20(30-2)19(12-14)25(28)29/h3-12H,1-2H3,(H,24,27)