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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

InChI

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