1-methyl-2-(phenylmethylsulfanyl)-5,6-dihydro-4H-pyrimidine hydrobromide

Systemtic Name: 1-methyl-2-(phenylmethylsulfanyl)-5,6-dihydro-4H-pyrimidine hydrobromide Openeye Name: 2-benzylsulfanyl-1-methyl-5,6-dihydro-4H-pyrimidine hydrobromide CAS Name: 1-methyl-2-(phenylmethylthio)-5,6-dihydro-4H-pyrimidine hydrobromide IUPAC Name: 2-benzylsulfanyl-1-methyl-5,6-dihydro-4H-pyrimidine hydrobromide Traditional Name: 2-(benzylthio)-1-methyl-5,6-dihydro-4H-pyrimidine hydrobromide Formula: C12H17BrN2S MolecularWeight: 301.24578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN=C1SCC2=CC=CC=C2.Br

Isomeric SMILES

CN1CCCN=C1SCC2=CC=CC=C2.Br

InChI

InChI=1S/C12H16N2S.BrH/c1-14-9-5-8-13-12(14)15-10-11-6-3-2-4-7-11;/h2-4,6-7H,5,8-10H2,1H3;1H