2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-propan-2-ylphenyl)ethanamide

Systemtic Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-propan-2-ylphenyl)ethanamide Openeye Name: N-(2-isopropylphenyl)-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-N-(2-propan-2-ylphenyl)acetamide IUPAC Name: 2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-N-(2-propan-2-ylphenyl)acetamide Traditional Name: 2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]-N-o-cumenyl-acetamide Formula: C18H17F3N2O3S MolecularWeight: 398.39939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N2O3S/c1-11(2)13-5-3-4-6-14(13)22-17(24)10-27-16-8-7-12(18(19,20)21)9-15(16)23(25)26/h3-9,11H,10H2,1-2H3,(H,22,24)