2-(2-fluorophenyl)sulfanyl-N-(3-methylbutyl)-5-nitro-benzamide

Systemtic Name: 2-(2-fluorophenyl)sulfanyl-N-(3-methylbutyl)-5-nitro-benzamide Openeye Name: 2-(2-fluorophenyl)sulfanyl-N-isopentyl-5-nitro-benzamide CAS Name: 2-[(2-fluorophenyl)thio]-N-(3-methylbutyl)-5-nitrobenzamide IUPAC Name: 2-(2-fluorophenyl)sulfanyl-N-(3-methylbutyl)-5-nitrobenzamide Traditional Name: 2-[(2-fluorophenyl)thio]-N-isoamyl-5-nitro-benzamide Formula: C18H19FN2O3S MolecularWeight: 362.418463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2F

Isomeric SMILES

CC(C)CCNC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])SC2=CC=CC=C2F

InChI

InChI=1S/C18H19FN2O3S/c1-12(2)9-10-20-18(22)14-11-13(21(23)24)7-8-16(14)25-17-6-4-3-5-15(17)19/h3-8,11-12H,9-10H2,1-2H3,(H,20,22)