N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide

Systemtic Name: N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide Openeye Name: N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]-2-isobutoxy-benzamide CAS Name: N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]-2-(2-methylpropoxy)benzamide IUPAC Name: N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-2-(2-methylpropoxy)benzamide Traditional Name: N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]-2-isobutoxy-benzamide Formula: C18H18FN3O4S MolecularWeight: 391.416623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CC(C)COC1=CC=CC=C1C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C18H18FN3O4S/c1-11(2)10-26-16-6-4-3-5-13(16)17(23)21-18(27)20-15-9-12(22(24)25)7-8-14(15)19/h3-9,11H,10H2,1-2H3,(H2,20,21,23,27)