4-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thian-4-yl]amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[(1,1-dioxothian-4-yl)amino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[(1,1-dioxo-4-thianyl)amino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[(1,1-dioxothian-4-yl)amino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[(1,1-diketothian-4-yl)amino]-2-(trifluoromethyl)benzonitrile Formula: C13H13F3N2O2S MolecularWeight: 318.31473

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

C1CS(=O)(=O)CCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C13H13F3N2O2S/c14-13(15,16)12-7-11(2-1-9(12)8-17)18-10-3-5-21(19,20)6-4-10/h1-2,7,10,18H,3-6H2