2-(2-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)methyl]-5-nitro-benzamide

Systemtic Name: 2-(2-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)methyl]-5-nitro-benzamide Openeye Name: 2-(2-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)methyl]-5-nitro-benzamide CAS Name: 2-[(2-fluorophenyl)thio]-N-[(4-methoxyphenyl)methyl]-5-nitrobenzamide IUPAC Name: 2-(2-fluorophenyl)sulfanyl-N-[(4-methoxyphenyl)methyl]-5-nitrobenzamide Traditional Name: 2-[(2-fluorophenyl)thio]-5-nitro-N-p-anisyl-benzamide Formula: C21H17FN2O4S MolecularWeight: 412.434083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])SC3=CC=CC=C3F

InChI

InChI=1S/C21H17FN2O4S/c1-28-16-9-6-14(7-10-16)13-23-21(25)17-12-15(24(26)27)8-11-19(17)29-20-5-3-2-4-18(20)22/h2-12H,13H2,1H3,(H,23,25)