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

Systemtic Name: N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]butanamide Openeye Name: N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]butanamide CAS Name: N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]butanamide IUPAC Name: N-[(2-fluoro-5-nitrophenyl)carbamothioyl]butanamide Traditional Name: N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]butyramide Formula: C11H12FN3O3S MolecularWeight: 285.294683

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])F

Isomeric SMILES

CCCC(=O)NC(=S)NC1=C(C=CC(=C1)[N+](=O)[O-])F

InChI

InChI=1S/C11H12FN3O3S/c1-2-3-10(16)14-11(19)13-9-6-7(15(17)18)4-5-8(9)12/h4-6H,2-3H2,1H3,(H2,13,14,16,19)