2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine

Systemtic Name: 2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine Openeye Name: 2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine CAS Name: 2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine IUPAC Name: 2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine Traditional Name: 2-(4-keto-6-phenyl-1H-pyrimidin-2-yl)-1-[3-(trifluoromethyl)phenyl]guanidine Formula: C18H14F3N5O MolecularWeight: 373.33187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)N=C(N)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)/N=C(\N)/NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C18H14F3N5O/c19-18(20,21)12-7-4-8-13(9-12)23-16(22)26-17-24-14(10-15(27)25-17)11-5-2-1-3-6-11/h1-10H,(H4,22,23,24,25,26,27)