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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=NC3=NC(=O)C=C(N3)C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)N/C(=N/C3=NC(=O)C=C(N3)C(F)(F)F)/N

InChI

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