4-azanyl-3-[2-(4-bromanylphenoxy)ethylsulfanyl]-6-methyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-3-[2-(4-bromanylphenoxy)ethylsulfanyl]-6-methyl-1,2,4-triazin-5-one Openeye Name: 4-amino-3-[2-(4-bromophenoxy)ethylsulfanyl]-6-methyl-1,2,4-triazin-5-one CAS Name: 4-amino-3-[2-(4-bromophenoxy)ethylthio]-6-methyl-1,2,4-triazin-5-one IUPAC Name: 4-amino-3-[2-(4-bromophenoxy)ethylsulfanyl]-6-methyl-1,2,4-triazin-5-one Traditional Name: 4-amino-3-[2-(4-bromophenoxy)ethylthio]-6-methyl-1,2,4-triazin-5-one Formula: C12H13BrN4O2S MolecularWeight: 357.22622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N(C1=O)N)SCCOC2=CC=C(C=C2)Br

Isomeric SMILES

CC1=NN=C(N(C1=O)N)SCCOC2=CC=C(C=C2)Br

InChI

InChI=1S/C12H13BrN4O2S/c1-8-11(18)17(14)12(16-15-8)20-7-6-19-10-4-2-9(13)3-5-10/h2-5H,6-7,14H2,1H3