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

Systemtic Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-pyrimidin-4-one Openeye Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-pyrimidin-4-one CAS Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[[1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-4-pyrimidinone IUPAC Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanylpyrimidin-4-one Traditional Name: 5-(4-bromobenzyl)-2-[[2-keto-1-methyl-2-(4-methylpiperidino)ethyl]thio]-3,6-dimethyl-pyrimidin-4-one Formula: C22H28BrN3O2S MolecularWeight: 478.44562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)C(C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1CCN(CC1)C(=O)C(C)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C22H28BrN3O2S/c1-14-9-11-26(12-10-14)20(27)16(3)29-22-24-15(2)19(21(28)25(22)4)13-17-5-7-18(23)8-6-17/h5-8,14,16H,9-13H2,1-4H3