N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-4-methyl-benzamide

Systemtic Name: N-[(2-fluoranyl-5-nitro-phenyl)carbamothioyl]-4-methyl-benzamide Openeye Name: N-[(2-fluoro-5-nitro-phenyl)carbamothioyl]-4-methyl-benzamide CAS Name: N-[(2-fluoro-5-nitroanilino)-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-4-methylbenzamide Traditional Name: N-[(2-fluoro-5-nitro-phenyl)thiocarbamoyl]-4-methyl-benzamide Formula: C15H12FN3O3S MolecularWeight: 333.337483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12FN3O3S/c1-9-2-4-10(5-3-9)14(20)18-15(23)17-13-8-11(19(21)22)6-7-12(13)16/h2-8H,1H3,(H2,17,18,20,23)