N-(3-ethylphenyl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-(3-ethylphenyl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(3-ethylphenyl)-2-[(2-fluorophenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(3-ethylphenyl)-2-[(2-fluorophenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(3-ethylphenyl)-2-[(2-fluorophenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(3-ethylphenyl)-2-[(2-fluorobenzyl)amino]-4-methyl-pyrimidine-5-carboxamide Formula: C21H21FN4O MolecularWeight: 364.416043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC=CC=C3F

InChI

InChI=1S/C21H21FN4O/c1-3-15-7-6-9-17(11-15)26-20(27)18-13-24-21(25-14(18)2)23-12-16-8-4-5-10-19(16)22/h4-11,13H,3,12H2,1-2H3,(H,26,27)(H,23,24,25)