5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-piperidin-1-ylethyl)pentanamide

Systemtic Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(2-piperidin-1-ylethyl)pentanamide Openeye Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-[2-(1-piperidyl)ethyl]pentanamide CAS Name: 5-[[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-[2-(1-piperidinyl)ethyl]pentanamide IUPAC Name: 5-[5-[(4-bromophenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-(2-piperidin-1-ylethyl)pentanamide Traditional Name: 5-[[5-(4-bromobenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-(2-piperidinoethyl)valeramide Formula: C25H35BrN4O2S MolecularWeight: 535.54

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCCCC2)C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SCCCCC(=O)NCCN2CCCCC2)C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C25H35BrN4O2S/c1-19-22(18-20-9-11-21(26)12-10-20)24(32)29(2)25(28-19)33-17-7-4-8-23(31)27-13-16-30-14-5-3-6-15-30/h9-12H,3-8,13-18H2,1-2H3,(H,27,31)