2,2-dimethyl-N-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenyl]propanamide Openeye Name: 2,2-dimethyl-N-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenyl]propanamide CAS Name: 2,2-dimethyl-N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]phenyl]propanamide IUPAC Name: 2,2-dimethyl-N-[2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylphenyl]propanamide Traditional Name: 2,2-dimethyl-N-[2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]phenyl]propionamide Formula: C18H17F3N2O3S MolecularWeight: 398.39939

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC=CC=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC=CC=C1SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N2O3S/c1-17(2,3)16(24)22-12-6-4-5-7-14(12)27-15-9-8-11(18(19,20)21)10-13(15)23(25)26/h4-10H,1-3H3,(H,22,24)