N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)pyrimidin-5-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)pyrimidin-5-yl]-4-fluoranyl-benzamide Openeye Name: N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)pyrimidin-5-yl]-4-fluoro-benzamide CAS Name: N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)-5-pyrimidinyl]-4-fluorobenzamide IUPAC Name: N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)pyrimidin-5-yl]-4-fluorobenzamide Traditional Name: N-[4-(dimethylamino)-6-(2,5-dimethylphenyl)pyrimidin-5-yl]-4-fluoro-benzamide Formula: C21H21FN4O MolecularWeight: 364.416043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C(=NC=N2)N(C)C)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C(=NC=N2)N(C)C)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H21FN4O/c1-13-5-6-14(2)17(11-13)18-19(20(26(3)4)24-12-23-18)25-21(27)15-7-9-16(22)10-8-15/h5-12H,1-4H3,(H,25,27)