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

Systemtic Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[5-(4-methylpiperidin-1-yl)-5-oxidanylidene-pentyl]sulfanyl-pyrimidin-4-one Openeye Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[5-(4-methyl-1-piperidyl)-5-oxo-pentyl]sulfanyl-pyrimidin-4-one CAS Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[[5-(4-methyl-1-piperidinyl)-5-oxopentyl]thio]-4-pyrimidinone IUPAC Name: 5-[(4-bromophenyl)methyl]-3,6-dimethyl-2-[5-(4-methylpiperidin-1-yl)-5-oxopentyl]sulfanylpyrimidin-4-one Traditional Name: 5-(4-bromobenzyl)-2-[[5-keto-5-(4-methylpiperidino)pentyl]thio]-3,6-dimethyl-pyrimidin-4-one Formula: C24H32BrN3O2S MolecularWeight: 506.49878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1CCN(CC1)C(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C24H32BrN3O2S/c1-17-11-13-28(14-12-17)22(29)6-4-5-15-31-24-26-18(2)21(23(30)27(24)3)16-19-7-9-20(25)10-8-19/h7-10,17H,4-6,11-16H2,1-3H3