N-[(3-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-[(4-methoxyphenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(3-chlorobenzyl)-4-methyl-2-(p-anisylamino)pyrimidine-5-carboxamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NCC2=CC(=CC=C2)Cl)NCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NCC2=CC(=CC=C2)Cl)NCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H21ClN4O2/c1-14-19(20(27)23-12-16-4-3-5-17(22)10-16)13-25-21(26-14)24-11-15-6-8-18(28-2)9-7-15/h3-10,13H,11-12H2,1-2H3,(H,23,27)(H,24,25,26)