2-[(4-bromophenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-5-ethyl-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-5-ethyl-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-5-ethyl-6-methyl-1H-pyrimidin-4-one Formula: C14H15BrN2OS MolecularWeight: 339.2507

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)Br)C

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C14H15BrN2OS/c1-3-12-9(2)16-14(17-13(12)18)19-8-10-4-6-11(15)7-5-10/h4-7H,3,8H2,1-2H3,(H,16,17,18)