6-(methoxymethyl)-3-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 6-(methoxymethyl)-3-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(phenylmethyl)pyrimidin-4-one Openeye Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-pyrimidin-4-one CAS Name: 6-(methoxymethyl)-3-methyl-2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-5-(phenylmethyl)-4-pyrimidinone IUPAC Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanylpyrimidin-4-one Traditional Name: 5-benzyl-2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-6-(methoxymethyl)-3-methyl-pyrimidin-4-one Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC(=C(C(=O)N2C)CC3=CC=CC=C3)COC

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC(=C(C(=O)N2C)CC3=CC=CC=C3)COC

InChI

InChI=1S/C22H29N3O3S/c1-16-9-11-25(12-10-16)20(26)15-29-22-23-19(14-28-3)18(21(27)24(22)2)13-17-7-5-4-6-8-17/h4-8,16H,9-15H2,1-3H3