6-(methoxymethyl)-3-methyl-2-(1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)sulfanyl-5-(phenylmethyl)pyrimidin-4-one

Systemtic Name: 6-(methoxymethyl)-3-methyl-2-(1-oxidanylidene-1-piperidin-1-yl-pentan-2-yl)sulfanyl-5-(phenylmethyl)pyrimidin-4-one Openeye Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-[1-(piperidine-1-carbonyl)butylsulfanyl]pyrimidin-4-one CAS Name: 6-(methoxymethyl)-3-methyl-2-[[1-oxo-1-(1-piperidinyl)pentan-2-yl]thio]-5-(phenylmethyl)-4-pyrimidinone IUPAC Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-(1-oxo-1-piperidin-1-ylpentan-2-yl)sulfanylpyrimidin-4-one Traditional Name: 5-benzyl-6-(methoxymethyl)-3-methyl-2-[1-(piperidine-1-carbonyl)butylthio]pyrimidin-4-one Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCCCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=CC=C3)COC

Isomeric SMILES

CCCC(C(=O)N1CCCCC1)SC2=NC(=C(C(=O)N2C)CC3=CC=CC=C3)COC

InChI

InChI=1S/C24H33N3O3S/c1-4-11-21(23(29)27-14-9-6-10-15-27)31-24-25-20(17-30-3)19(22(28)26(24)2)16-18-12-7-5-8-13-18/h5,7-8,12-13,21H,4,6,9-11,14-17H2,1-3H3