4-azanyl-3-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-azanyl-3-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-one CAS Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-amino-3-[(4-chlorophenyl)methyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-amino-3-(4-chlorobenzyl)-1H-1,2,4-triazol-5-one Formula: C9H9ClN4O MolecularWeight: 224.64696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=NNC(=O)N2N)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2=NNC(=O)N2N)Cl

InChI

InChI=1S/C9H9ClN4O/c10-7-3-1-6(2-4-7)5-8-12-13-9(15)14(8)11/h1-4H,5,11H2,(H,13,15)