2-[3-(3-bromanylphenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[3-(3-bromanylphenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[3-(3-bromophenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[3-(3-bromophenoxy)propylthio]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[3-(3-bromophenoxy)propylsulfanyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[3-(3-bromophenoxy)propylthio]-6-methyl-1H-pyrimidin-4-one Formula: C14H15BrN2O2S MolecularWeight: 355.2501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H15BrN2O2S/c1-10-8-13(18)17-14(16-10)20-7-3-6-19-12-5-2-4-11(15)9-12/h2,4-5,8-9H,3,6-7H2,1H3,(H,16,17,18)