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

Systemtic Name: N-[2-chloranyl-4-(trifluoromethyl)phenyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-1,1-dioxo-thian-4-amine CAS Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[2-chloro-4-(trifluoromethyl)phenyl]-1,1-dioxothian-4-amine Traditional Name: [2-chloro-4-(trifluoromethyl)phenyl]-(1,1-diketothian-4-yl)amine Formula: C12H13ClF3NO2S MolecularWeight: 327.75033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=C(C=C(C=C2)C(F)(F)F)Cl

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=C(C=C(C=C2)C(F)(F)F)Cl

InChI

InChI=1S/C12H13ClF3NO2S/c13-10-7-8(12(14,15)16)1-2-11(10)17-9-3-5-20(18,19)6-4-9/h1-2,7,9,17H,3-6H2