3-[(4,5-dimethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(2-methoxyethyl)benzamide

Systemtic Name: 3-[(4,5-dimethyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(2-methoxyethyl)benzamide Openeye Name: 3-[(4,5-dimethyl-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-N-(2-methoxyethyl)benzamide CAS Name: 3-[[[4,5-dimethyl-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-(2-methoxyethyl)benzamide IUPAC Name: 3-[(4,5-dimethyl-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-(2-methoxyethyl)benzamide Traditional Name: 3-[[(4,5-dimethyl-6-morpholino-pyrimidin-2-yl)thio]methyl]-N-(2-methoxyethyl)benzamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1N2CCOCC2)SCC3=CC=CC(=C3)C(=O)NCCOC)C

Isomeric SMILES

CC1=C(N=C(N=C1N2CCOCC2)SCC3=CC=CC(=C3)C(=O)NCCOC)C

InChI

InChI=1S/C21H28N4O3S/c1-15-16(2)23-21(24-19(15)25-8-11-28-12-9-25)29-14-17-5-4-6-18(13-17)20(26)22-7-10-27-3/h4-6,13H,7-12,14H2,1-3H3,(H,22,26)