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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[(3-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[(3-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(3-methoxyphenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[(3-methoxyphenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-(m-anisylamino)-4-methyl-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=C(C=C2)Cl)NCC3=CC(=CC=C3)OC

Isomeric SMILES

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

InChI

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