2-[(2-fluorophenyl)methylamino]-N-(2-methoxy-5-methyl-phenyl)-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: 2-[(2-fluorophenyl)methylamino]-N-(2-methoxy-5-methyl-phenyl)-4-methyl-pyrimidine-5-carboxamide Openeye Name: 2-[(2-fluorophenyl)methylamino]-N-(2-methoxy-5-methyl-phenyl)-4-methyl-pyrimidine-5-carboxamide CAS Name: 2-[(2-fluorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)-4-methyl-5-pyrimidinecarboxamide IUPAC Name: 2-[(2-fluorophenyl)methylamino]-N-(2-methoxy-5-methylphenyl)-4-methylpyrimidine-5-carboxamide Traditional Name: 2-[(2-fluorobenzyl)amino]-N-(2-methoxy-5-methyl-phenyl)-4-methyl-pyrimidine-5-carboxamide Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

InChI

InChI=1S/C21H21FN4O2/c1-13-8-9-19(28-3)18(10-13)26-20(27)16-12-24-21(25-14(16)2)23-11-15-6-4-5-7-17(15)22/h4-10,12H,11H2,1-3H3,(H,26,27)(H,23,24,25)