2-fluoranyl-N-[4-[(3-nitrophenyl)carbamothioylamino]phenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[4-[(3-nitrophenyl)carbamothioylamino]phenyl]benzamide Openeye Name: 2-fluoro-N-[4-[(3-nitrophenyl)carbamothioylamino]phenyl]benzamide CAS Name: 2-fluoro-N-[4-[[(3-nitroanilino)-sulfanylidenemethyl]amino]phenyl]benzamide IUPAC Name: 2-fluoro-N-[4-[(3-nitrophenyl)carbamothioylamino]phenyl]benzamide Traditional Name: 2-fluoro-N-[4-[(3-nitrophenyl)thiocarbamoylamino]phenyl]benzamide Formula: C20H15FN4O3S MolecularWeight: 410.421503

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC(=CC=C3)[N+](=O)[O-])F

InChI

InChI=1S/C20H15FN4O3S/c21-18-7-2-1-6-17(18)19(26)22-13-8-10-14(11-9-13)23-20(29)24-15-4-3-5-16(12-15)25(27)28/h1-12H,(H,22,26)(H2,23,24,29)