N-ethyl-4-[[4-(methoxymethyl)-6-morpholin-4-yl-pyrimidin-2-yl]sulfanylmethyl]-N-methyl-benzamide

Systemtic Name: N-ethyl-4-[[4-(methoxymethyl)-6-morpholin-4-yl-pyrimidin-2-yl]sulfanylmethyl]-N-methyl-benzamide Openeye Name: N-ethyl-4-[[4-(methoxymethyl)-6-morpholino-pyrimidin-2-yl]sulfanylmethyl]-N-methyl-benzamide CAS Name: N-ethyl-4-[[[4-(methoxymethyl)-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-methylbenzamide IUPAC Name: N-ethyl-4-[[4-(methoxymethyl)-6-morpholin-4-ylpyrimidin-2-yl]sulfanylmethyl]-N-methylbenzamide Traditional Name: N-ethyl-4-[[[4-(methoxymethyl)-6-morpholino-pyrimidin-2-yl]thio]methyl]-N-methyl-benzamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCOCC3)COC

Isomeric SMILES

CCN(C)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N3CCOCC3)COC

InChI

InChI=1S/C21H28N4O3S/c1-4-24(2)20(26)17-7-5-16(6-8-17)15-29-21-22-18(14-27-3)13-19(23-21)25-9-11-28-12-10-25/h5-8,13H,4,9-12,14-15H2,1-3H3