1-[3-[[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethylamino]methyl]phenyl]ethanone

Systemtic Name: 1-[3-[[1-(4-methyl-2-pyridin-4-yl-pyrimidin-5-yl)ethylamino]methyl]phenyl]ethanone Openeye Name: 1-[3-[[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethylamino]methyl]phenyl]ethanone CAS Name: 1-[3-[[1-(4-methyl-2-pyridin-4-yl-5-pyrimidinyl)ethylamino]methyl]phenyl]ethanone IUPAC Name: 1-[3-[[1-(4-methyl-2-pyridin-4-ylpyrimidin-5-yl)ethylamino]methyl]phenyl]ethanone Traditional Name: 1-[3-[[1-[4-methyl-2-(4-pyridyl)pyrimidin-5-yl]ethylamino]methyl]phenyl]ethanone Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(C)NCC2=CC=CC(=C2)C(=O)C)C3=CC=NC=C3

Isomeric SMILES

CC1=NC(=NC=C1C(C)NCC2=CC=CC(=C2)C(=O)C)C3=CC=NC=C3

InChI

InChI=1S/C21H22N4O/c1-14(23-12-17-5-4-6-19(11-17)16(3)26)20-13-24-21(25-15(20)2)18-7-9-22-10-8-18/h4-11,13-14,23H,12H2,1-3H3