2-[[4-(4-fluoranylphenoxy)phenyl]methylamino]-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 2-[[4-(4-fluoranylphenoxy)phenyl]methylamino]-6-(4-methoxyphenyl)-4-oxidanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 2-[[4-(4-fluorophenoxy)phenyl]methylamino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile CAS Name: 2-[[4-(4-fluorophenoxy)phenyl]methylamino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile IUPAC Name: 2-[[4-(4-fluorophenoxy)phenyl]methylamino]-6-(4-methoxyphenyl)-4-oxo-1H-pyrimidine-5-carbonitrile Traditional Name: 2-[[4-(4-fluorophenoxy)benzyl]amino]-4-keto-6-(4-methoxyphenyl)-1H-pyrimidine-5-carbonitrile Formula: C25H19FN4O3 MolecularWeight: 442.441763

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC=C(C=C3)OC4=CC=C(C=C4)F)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(C(=O)N=C(N2)NCC3=CC=C(C=C3)OC4=CC=C(C=C4)F)C#N

InChI

InChI=1S/C25H19FN4O3/c1-32-19-10-4-17(5-11-19)23-22(14-27)24(31)30-25(29-23)28-15-16-2-8-20(9-3-16)33-21-12-6-18(26)7-13-21/h2-13H,15H2,1H3,(H2,28,29,30,31)