N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide Openeye Name: N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)sulfanyl-5-nitro-benzamide CAS Name: N-(2,5-dimethoxyphenyl)-2-[(2-fluorophenyl)thio]-5-nitrobenzamide IUPAC Name: N-(2,5-dimethoxyphenyl)-2-(2-fluorophenyl)sulfanyl-5-nitrobenzamide Traditional Name: N-(2,5-dimethoxyphenyl)-2-[(2-fluorophenyl)thio]-5-nitro-benzamide Formula: C21H17FN2O5S MolecularWeight: 428.433483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17FN2O5S/c1-28-14-8-9-18(29-2)17(12-14)23-21(25)15-11-13(24(26)27)7-10-19(15)30-20-6-4-3-5-16(20)22/h3-12H,1-2H3,(H,23,25)