N-[4-(dimethylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-[4-(dimethylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-[4-(dimethylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide CAS Name: N-[4-[dimethylamino(oxo)methyl]phenyl]-2-[(2-fluorophenyl)thio]-5-nitrobenzamide IUPAC Name: N-[4-(dimethylcarbamoyl)phenyl]-2-(2-fluorophenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-[4-(dimethylcarbamoyl)phenyl]-2-[(2-fluorophenyl)thio]-5-nitro-benzamide Formula: C22H18FN3O4S MolecularWeight: 439.459423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

InChI

InChI=1S/C22H18FN3O4S/c1-25(2)22(28)14-7-9-15(10-8-14)24-21(27)17-13-16(26(29)30)11-12-19(17)31-20-6-4-3-5-18(20)23/h3-13H,1-2H3,(H,24,27)