6-(2-azanyl-5-bromanyl-phenyl)-3-hexylsulfanyl-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(2-azanyl-5-bromanyl-phenyl)-3-hexylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-(2-amino-5-bromo-phenyl)-3-hexylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-(2-amino-5-bromophenyl)-3-(hexylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-(2-amino-5-bromophenyl)-3-hexylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 6-(2-amino-5-bromo-phenyl)-3-(hexylthio)-2H-1,2,4-triazin-5-one Formula: C15H19BrN4OS MolecularWeight: 383.30656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC(=O)C(=NN1)C2=C(C=CC(=C2)Br)N

Isomeric SMILES

CCCCCCSC1=NC(=O)C(=NN1)C2=C(C=CC(=C2)Br)N

InChI

InChI=1S/C15H19BrN4OS/c1-2-3-4-5-8-22-15-18-14(21)13(19-20-15)11-9-10(16)6-7-12(11)17/h6-7,9H,2-5,8,17H2,1H3,(H,18,20,21)