4-[(4-ethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-[(4-ethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-[(4-ethyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-N-(2-pyridylmethyl)benzamide CAS Name: 4-[[[4-ethyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-[(4-ethyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-[[(4-ethyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-N-(2-pyridylmethyl)benzamide Formula: C24H27N5O2S MolecularWeight: 449.56848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3)N4CCOCC4

Isomeric SMILES

CCC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=N3)N4CCOCC4

InChI

InChI=1S/C24H27N5O2S/c1-2-20-15-22(29-11-13-31-14-12-29)28-24(27-20)32-17-18-6-8-19(9-7-18)23(30)26-16-21-5-3-4-10-25-21/h3-10,15H,2,11-14,16-17H2,1H3,(H,26,30)