1,1-bis(oxidanylidene)-N-[[2-(trifluoromethyl)phenyl]methyl]thian-4-amine

Systemtic Name: 1,1-bis(oxidanylidene)-N-[[2-(trifluoromethyl)phenyl]methyl]thian-4-amine Openeye Name: 1,1-dioxo-N-[[2-(trifluoromethyl)phenyl]methyl]thian-4-amine CAS Name: 1,1-dioxo-N-[[2-(trifluoromethyl)phenyl]methyl]-4-thianamine IUPAC Name: 1,1-dioxo-N-[[2-(trifluoromethyl)phenyl]methyl]thian-4-amine Traditional Name: (1,1-diketothian-4-yl)-[2-(trifluoromethyl)benzyl]amine Formula: C13H16F3NO2S MolecularWeight: 307.33185

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NCC2=CC=CC=C2C(F)(F)F

Isomeric SMILES

C1CS(=O)(=O)CCC1NCC2=CC=CC=C2C(F)(F)F

InChI

InChI=1S/C13H16F3NO2S/c14-13(15,16)12-4-2-1-3-10(12)9-17-11-5-7-20(18,19)8-6-11/h1-4,11,17H,5-9H2