2-chloranyl-N-[(2-nitrophenyl)sulfanyl-[4-(trifluoromethyloxy)phenyl]carbamoyl]benzamide

Systemtic Name: 2-chloranyl-N-[(2-nitrophenyl)sulfanyl-[4-(trifluoromethyloxy)phenyl]carbamoyl]benzamide Openeye Name: 2-chloro-N-[(2-nitrophenyl)sulfanyl-[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide CAS Name: 2-chloro-N-[[N-[(2-nitrophenyl)thio]-4-(trifluoromethoxy)anilino]-oxomethyl]benzamide IUPAC Name: 2-chloro-N-[(2-nitrophenyl)sulfanyl-[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide Traditional Name: 2-chloro-N-[[(2-nitrophenyl)thio]-[4-(trifluoromethoxy)phenyl]carbamoyl]benzamide Formula: C21H13ClF3N3O5S MolecularWeight: 511.85823

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=O)N(C2=CC=C(C=C2)OC(F)(F)F)SC3=CC=CC=C3[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=O)N(C2=CC=C(C=C2)OC(F)(F)F)SC3=CC=CC=C3[N+](=O)[O-])Cl

InChI

InChI=1S/C21H13ClF3N3O5S/c22-16-6-2-1-5-15(16)19(29)26-20(30)27(34-18-8-4-3-7-17(18)28(31)32)13-9-11-14(12-10-13)33-21(23,24)25/h1-12H,(H,26,29,30)