6-[(3-bromophenyl)methyl]-5-ethyl-2-methylsulfanyl-1H-pyrimidin-4-one

Systemtic Name: 6-[(3-bromophenyl)methyl]-5-ethyl-2-methylsulfanyl-1H-pyrimidin-4-one Openeye Name: 6-[(3-bromophenyl)methyl]-5-ethyl-2-methylsulfanyl-1H-pyrimidin-4-one CAS Name: 6-[(3-bromophenyl)methyl]-5-ethyl-2-(methylthio)-1H-pyrimidin-4-one IUPAC Name: 6-[(3-bromophenyl)methyl]-5-ethyl-2-methylsulfanyl-1H-pyrimidin-4-one Traditional Name: 6-(3-bromobenzyl)-5-ethyl-2-(methylthio)-1H-pyrimidin-4-one Formula: C14H15BrN2OS MolecularWeight: 339.2507

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SC)CC2=CC(=CC=C2)Br

Isomeric SMILES

CCC1=C(NC(=NC1=O)SC)CC2=CC(=CC=C2)Br

InChI

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