[azanyl-[[3-(trifluoromethyl)phenyl]amino]methylidene]-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)azanium

Systemtic Name: [azanyl-[[3-(trifluoromethyl)phenyl]amino]methylidene]-(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)azanium Openeye Name: [amino-[3-(trifluoromethyl)anilino]methylene]-(4-oxo-6-propyl-1H-pyrimidin-2-yl)ammonium CAS Name: [amino-[3-(trifluoromethyl)anilino]methylidene]-(4-oxo-6-propyl-1H-pyrimidin-2-yl)ammonium IUPAC Name: [amino-[3-(trifluoromethyl)anilino]methylidene]-(4-oxo-6-propyl-1H-pyrimidin-2-yl)azanium Traditional Name: [amino-[3-(trifluoromethyl)anilino]methylene]-(4-keto-6-propyl-1H-pyrimidin-2-yl)ammonium Formula: C15H17F3N5O+ MolecularWeight: 340.32359

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)[NH+]=C(N)NC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)[NH+]=C(N)NC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C15H16F3N5O/c1-2-4-10-8-12(24)22-14(21-10)23-13(19)20-11-6-3-5-9(7-11)15(16,17)18/h3,5-8H,2,4H2,1H3,(H4,19,20,21,22,23,24)/p+1