N-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(3-fluoro-4-methyl-phenyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[(3-fluoro-4-methylanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(3-fluoro-4-methylphenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(3-fluoro-4-methyl-phenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C15H12FN3O3S MolecularWeight: 333.337483

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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