N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]-2-(3-methylphenoxy)acetamide Formula: C16H14FN3O4S MolecularWeight: 363.363463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])F

InChI

InChI=1S/C16H14FN3O4S/c1-10-3-2-4-12(7-10)24-9-15(21)19-16(25)18-14-8-11(20(22)23)5-6-13(14)17/h2-8H,9H2,1H3,(H2,18,19,21,25)