6-(methoxymethyl)-3-methyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-5-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 6-(methoxymethyl)-3-methyl-2-(4-morpholin-4-yl-4-oxidanylidene-butyl)sulfanyl-5-(phenylmethyl)pyrimidin-4-one Openeye Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-(4-morpholino-4-oxo-butyl)sulfanyl-pyrimidin-4-one CAS Name: 6-(methoxymethyl)-3-methyl-2-[[4-(4-morpholinyl)-4-oxobutyl]thio]-5-(phenylmethyl)-4-pyrimidinone IUPAC Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-(4-morpholin-4-yl-4-oxobutyl)sulfanylpyrimidin-4-one Traditional Name: 5-benzyl-2-[(4-keto-4-morpholino-butyl)thio]-6-(methoxymethyl)-3-methyl-pyrimidin-4-one Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1SCCCC(=O)N2CCOCC2)COC)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N=C1SCCCC(=O)N2CCOCC2)COC)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3O4S/c1-24-21(27)18(15-17-7-4-3-5-8-17)19(16-28-2)23-22(24)30-14-6-9-20(26)25-10-12-29-13-11-25/h3-5,7-8H,6,9-16H2,1-2H3