4-(3-iodanyl-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile; prop-1-ene

Systemtic Name: 4-(3-iodanyl-4,4-dimethyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile; prop-1-ene Openeye Name: 4-(3-iodo-4,4-dimethyl-5-oxo-2-thioxo-imidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile; prop-1-ene CAS Name: 4-(3-iodo-4,4-dimethyl-5-oxo-2-sulfanylidene-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile; 1-propene IUPAC Name: 4-(3-iodo-4,4-dimethyl-5-oxo-2-sulfanylideneimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile; prop-1-ene Traditional Name: 4-(3-iodo-5-keto-4,4-dimethyl-2-thioxo-imidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile; prop-1-ene Formula: C16H15F3IN3OS MolecularWeight: 481.27448

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Descriptors Computed from Structure

Canonical SMILES:

CC=C.CC1(C(=O)N(C(=S)N1I)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

Isomeric SMILES

CC=C.CC1(C(=O)N(C(=S)N1I)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C13H9F3IN3OS.C3H6/c1-12(2)10(21)19(11(22)20(12)17)8-4-3-7(6-18)9(5-8)13(14,15)16;1-3-2/h3-5H,1-2H3;3H,1H2,2H3