N6-[[4-(cyanocarbamoyl)phenyl]methyl]-N4-[(3-methoxyphenyl)methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N6-[[4-(cyanocarbamoyl)phenyl]methyl]-N4-[(3-methoxyphenyl)methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N6-[[4-(cyanocarbamoyl)phenyl]methyl]-N4-[(3-methoxyphenyl)methyl]pyrimidine-4,6-dicarboxamide CAS Name: N6-[[4-[(cyanoamino)-oxomethyl]phenyl]methyl]-N4-[(3-methoxyphenyl)methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 6-N-[[4-(cyanocarbamoyl)phenyl]methyl]-4-N-[(3-methoxyphenyl)methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N'-[4-(cyanocarbamoyl)benzyl]-N-m-anisyl-pyrimidine-4,6-dicarboxamide Formula: C23H20N6O4 MolecularWeight: 444.4427

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)C(=O)NC#N

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)C(=O)NC#N

InChI

InChI=1S/C23H20N6O4/c1-33-18-4-2-3-16(9-18)12-26-23(32)20-10-19(28-14-29-20)22(31)25-11-15-5-7-17(8-6-15)21(30)27-13-24/h2-10,14H,11-12H2,1H3,(H,25,31)(H,26,32)(H,27,30)