2-fluoranyl-N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 2-fluoranyl-N-[3-[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]benzamide Openeye Name: 2-fluoro-N-[3-[2-(4-nitroanilino)-2-oxo-ethyl]sulfanylphenyl]benzamide CAS Name: 2-fluoro-N-[3-[[2-(4-nitroanilino)-2-oxoethyl]thio]phenyl]benzamide IUPAC Name: 2-fluoro-N-[3-[2-(4-nitroanilino)-2-oxoethyl]sulfanylphenyl]benzamide Traditional Name: 2-fluoro-N-[3-[[2-keto-2-(4-nitroanilino)ethyl]thio]phenyl]benzamide Formula: C21H16FN3O4S MolecularWeight: 425.432843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16FN3O4S/c22-19-7-2-1-6-18(19)21(27)24-15-4-3-5-17(12-15)30-13-20(26)23-14-8-10-16(11-9-14)25(28)29/h1-12H,13H2,(H,23,26)(H,24,27)