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

Systemtic Name: 5-[(4-bromophenyl)methyl]-2-[5-(4-ethylpiperazin-1-yl)-5-oxidanylidene-pentyl]sulfanyl-3,6-dimethyl-pyrimidin-4-one Openeye Name: 5-[(4-bromophenyl)methyl]-2-[5-(4-ethylpiperazin-1-yl)-5-oxo-pentyl]sulfanyl-3,6-dimethyl-pyrimidin-4-one CAS Name: 5-[(4-bromophenyl)methyl]-2-[[5-(4-ethyl-1-piperazinyl)-5-oxopentyl]thio]-3,6-dimethyl-4-pyrimidinone IUPAC Name: 5-[(4-bromophenyl)methyl]-2-[5-(4-ethylpiperazin-1-yl)-5-oxopentyl]sulfanyl-3,6-dimethylpyrimidin-4-one Traditional Name: 5-(4-bromobenzyl)-2-[[5-(4-ethylpiperazino)-5-keto-pentyl]thio]-3,6-dimethyl-pyrimidin-4-one Formula: C24H33BrN4O2S MolecularWeight: 521.51342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

Isomeric SMILES

CCN1CCN(CC1)C(=O)CCCCSC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)Br)C

InChI

InChI=1S/C24H33BrN4O2S/c1-4-28-12-14-29(15-13-28)22(30)7-5-6-16-32-24-26-18(2)21(23(31)27(24)3)17-19-8-10-20(25)11-9-19/h8-11H,4-7,12-17H2,1-3H3