6-[(4-chlorophenyl)methyl]-3-(3-oxidanylpropylamino)-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-chlorophenyl)methyl]-3-(3-oxidanylpropylamino)-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-chlorophenyl)methyl]-3-(3-hydroxypropylamino)-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-chlorophenyl)methyl]-3-(3-hydroxypropylamino)-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-chlorophenyl)methyl]-3-(3-hydroxypropylamino)-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-chlorobenzyl)-3-(3-hydroxypropylamino)-2H-1,2,4-triazin-5-one Formula: C13H15ClN4O2 MolecularWeight: 294.7368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NNC(=NC2=O)NCCCO)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=NNC(=NC2=O)NCCCO)Cl

InChI

InChI=1S/C13H15ClN4O2/c14-10-4-2-9(3-5-10)8-11-12(20)16-13(18-17-11)15-6-1-7-19/h2-5,19H,1,6-8H2,(H2,15,16,18,20)