6-azanyl-2-oxidanylidene-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethyloxy)phenyl]pyrimidine-4-carbonitrile

Systemtic Name: 6-azanyl-2-oxidanylidene-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethyloxy)phenyl]pyrimidine-4-carbonitrile Openeye Name: 6-amino-2-oxo-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile CAS Name: 6-amino-2-oxo-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethoxy)phenyl]-4-pyrimidinecarbonitrile IUPAC Name: 6-amino-2-oxo-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile Traditional Name: 6-amino-2-keto-5-[[(E)-3-phenylprop-2-enylidene]amino]-1-[4-(trifluoromethoxy)phenyl]pyrimidine-4-carbonitrile Formula: C21H14F3N5O2 MolecularWeight: 425.36337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC=NC2=C(N(C(=O)N=C2C#N)C3=CC=C(C=C3)OC(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C=NC2=C(N(C(=O)N=C2C#N)C3=CC=C(C=C3)OC(F)(F)F)N

InChI

InChI=1S/C21H14F3N5O2/c22-21(23,24)31-16-10-8-15(9-11-16)29-19(26)18(17(13-25)28-20(29)30)27-12-4-7-14-5-2-1-3-6-14/h1-12H,26H2/b7-4+,27-12?