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

Systemtic Name: 6-(2-azanyl-5-bromanyl-phenyl)-3-butylsulfanyl-2H-1,2,4-triazin-5-one Openeye Name: 6-(2-amino-5-bromo-phenyl)-3-butylsulfanyl-2H-1,2,4-triazin-5-one CAS Name: 6-(2-amino-5-bromophenyl)-3-(butylthio)-2H-1,2,4-triazin-5-one IUPAC Name: 6-(2-amino-5-bromophenyl)-3-butylsulfanyl-2H-1,2,4-triazin-5-one Traditional Name: 6-(2-amino-5-bromo-phenyl)-3-(butylthio)-2H-1,2,4-triazin-5-one Formula: C13H15BrN4OS MolecularWeight: 355.2534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C(=NN1)C2=C(C=CC(=C2)Br)N

Isomeric SMILES

CCCCSC1=NC(=O)C(=NN1)C2=C(C=CC(=C2)Br)N

InChI

InChI=1S/C13H15BrN4OS/c1-2-3-6-20-13-16-12(19)11(17-18-13)9-7-8(14)4-5-10(9)15/h4-5,7H,2-3,6,15H2,1H3,(H,16,18,19)