5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]sulfanyl-pyrimidin-4-one

Systemtic Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-hexan-2-yl]sulfanyl-pyrimidin-4-one Openeye Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidine-1-carbonyl)pentylsulfanyl]pyrimidin-4-one CAS Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[[1-(4-methyl-1-piperidinyl)-1-oxohexan-2-yl]thio]-4-pyrimidinone IUPAC Name: 5-[(4-fluorophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxohexan-2-yl]sulfanylpyrimidin-4-one Traditional Name: 5-(4-fluorobenzyl)-3,6-dimethyl-2-[1-(4-methylpiperidine-1-carbonyl)pentylthio]pyrimidin-4-one Formula: C25H34FN3O2S MolecularWeight: 459.619763

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)N1CCC(CC1)C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

Isomeric SMILES

CCCCC(C(=O)N1CCC(CC1)C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)F)C

InChI

InChI=1S/C25H34FN3O2S/c1-5-6-7-22(24(31)29-14-12-17(2)13-15-29)32-25-27-18(3)21(23(30)28(25)4)16-19-8-10-20(26)11-9-19/h8-11,17,22H,5-7,12-16H2,1-4H3