4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: 4-[2-[(4-bromanyl-2-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: 4-[2-(4-bromo-2-fluoro-anilino)-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: 4-[[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: 4-[2-(4-bromo-2-fluoroanilino)-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: 4-[[2-(4-bromo-2-fluoro-anilino)-2-keto-ethyl]thio]-3-nitro-benzamide Formula: C15H11BrFN3O4S MolecularWeight: 428.232943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)[N+](=O)[O-])SCC(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C15H11BrFN3O4S/c16-9-2-3-11(10(17)6-9)19-14(21)7-25-13-4-1-8(15(18)22)5-12(13)20(23)24/h1-6H,7H2,(H2,18,22)(H,19,21)