N-(4-chloranyl-2-fluoranyl-phenyl)-4-[2-[(2-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-4-[2-[(2-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-3-nitro-benzamide Openeye Name: N-(4-chloro-2-fluoro-phenyl)-4-[2-[(2-methoxyphenyl)methylamino]-2-oxo-ethyl]sulfanyl-3-nitro-benzamide CAS Name: N-(4-chloro-2-fluorophenyl)-4-[[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]thio]-3-nitrobenzamide IUPAC Name: N-(4-chloro-2-fluorophenyl)-4-[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl]sulfanyl-3-nitrobenzamide Traditional Name: N-(4-chloro-2-fluoro-phenyl)-4-[[2-keto-2-(o-anisylamino)ethyl]thio]-3-nitro-benzamide Formula: C23H19ClFN3O5S MolecularWeight: 503.930463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)CSC2=C(C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)CSC2=C(C=C(C=C2)C(=O)NC3=C(C=C(C=C3)Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C23H19ClFN3O5S/c1-33-20-5-3-2-4-15(20)12-26-22(29)13-34-21-9-6-14(10-19(21)28(31)32)23(30)27-18-8-7-16(24)11-17(18)25/h2-11H,12-13H2,1H3,(H,26,29)(H,27,30)