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

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-2-[(3-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-2-[(3-methoxyphenyl)methylamino]-4-methyl-pyrimidine-5-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-2-[(3-methoxyphenyl)methylamino]-4-methyl-5-pyrimidinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-2-[(3-methoxyphenyl)methylamino]-4-methylpyrimidine-5-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-2-(m-anisylamino)-4-methyl-pyrimidine-5-carboxamide Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC(=CC=C3)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CN=C(N=C2C)NCC3=CC(=CC=C3)OC)F

InChI

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