4-(4-fluorophenyl)sulfanyl-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide

Systemtic Name: 4-(4-fluorophenyl)sulfanyl-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide Openeye Name: 4-(4-fluorophenyl)sulfanyl-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide CAS Name: 4-[(4-fluorophenyl)thio]-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide IUPAC Name: 4-(4-fluorophenyl)sulfanyl-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide Traditional Name: 4-[(4-fluorophenyl)thio]-3-nitro-N-(3,4,5-trimethoxyphenyl)benzamide Formula: C22H19FN2O6S MolecularWeight: 458.459463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=C(C=C2)SC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C22H19FN2O6S/c1-29-18-11-15(12-19(30-2)21(18)31-3)24-22(26)13-4-9-20(17(10-13)25(27)28)32-16-7-5-14(23)6-8-16/h4-12H,1-3H3,(H,24,26)