6-(1-azanylpropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one

Systemtic Name: 6-(1-azanylpropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one Openeye Name: 6-(1-aminopropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one CAS Name: 6-(1-aminopropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one IUPAC Name: 6-(1-aminopropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one Traditional Name: 6-(1-aminopropyl)-3-(3-bromophenyl)-2H-1,2,4-triazin-5-one Formula: C12H13BrN4O MolecularWeight: 309.16182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)Br)N

Isomeric SMILES

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)Br)N

InChI

InChI=1S/C12H13BrN4O/c1-2-9(14)10-12(18)15-11(17-16-10)7-4-3-5-8(13)6-7/h3-6,9H,2,14H2,1H3,(H,15,17,18)