2-[(4-bromophenyl)methylsulfanyl]-9-methyl-pyrido[1,2-a][1,3,5]triazin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-9-methyl-pyrido[1,2-a][1,3,5]triazin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-9-methyl-pyrido[1,2-a][1,3,5]triazin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-9-methyl-4-pyrido[1,2-a][1,3,5]triazinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-9-methylpyrido[1,2-a][1,3,5]triazin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-9-methyl-pyrido[1,2-a][1,3,5]triazin-4-one Formula: C15H12BrN3OS MolecularWeight: 362.24428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=NC2=O)SCC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC=CN2C1=NC(=NC2=O)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H12BrN3OS/c1-10-3-2-8-19-13(10)17-14(18-15(19)20)21-9-11-4-6-12(16)7-5-11/h2-8H,9H2,1H3