N4,N6-bis[(4-cyanophenyl)methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N4,N6-bis[(4-cyanophenyl)methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4,N6-bis[(4-cyanophenyl)methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4,N6-bis[(4-cyanophenyl)methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N,6-N-bis[(4-cyanophenyl)methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N,N'-bis(4-cyanobenzyl)pyrimidine-4,6-dicarboxamide Formula: C22H16N6O2 MolecularWeight: 396.40144

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CC=C(C=C3)C#N)C#N

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CC=C(C=C3)C#N)C#N

InChI

InChI=1S/C22H16N6O2/c23-10-15-1-5-17(6-2-15)12-25-21(29)19-9-20(28-14-27-19)22(30)26-13-18-7-3-16(11-24)4-8-18/h1-9,14H,12-13H2,(H,25,29)(H,26,30)