4-(5-azanylidene-4,4-dimethyl-3-pentyl-2-sulfanylidene-imidazolidin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-(5-azanylidene-4,4-dimethyl-3-pentyl-2-sulfanylidene-imidazolidin-1-yl)-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-(5-imino-4,4-dimethyl-3-pentyl-2-thioxo-imidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile CAS Name: 4-(5-imino-4,4-dimethyl-3-pentyl-2-sulfanylidene-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-(5-imino-4,4-dimethyl-3-pentyl-2-sulfanylideneimidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile Traditional Name: 4-(3-amyl-5-imino-4,4-dimethyl-2-thioxo-imidazolidin-1-yl)-2-(trifluoromethyl)benzonitrile Formula: C18H21F3N4S MolecularWeight: 382.44635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=S)N(C(=N)C1(C)C)C2=CC(=C(C=C2)C#N)C(F)(F)F

Isomeric SMILES

CCCCCN1C(=S)N(C(=N)C1(C)C)C2=CC(=C(C=C2)C#N)C(F)(F)F

InChI

InChI=1S/C18H21F3N4S/c1-4-5-6-9-24-16(26)25(15(23)17(24,2)3)13-8-7-12(11-22)14(10-13)18(19,20)21/h7-8,10,23H,4-6,9H2,1-3H3