5-(4-chlorophenyl)-2-methyl-4-(phenylmethyl)-1,2,4-triazol-3-one

Systemtic Name: 5-(4-chlorophenyl)-2-methyl-4-(phenylmethyl)-1,2,4-triazol-3-one Openeye Name: 4-benzyl-5-(4-chlorophenyl)-2-methyl-1,2,4-triazol-3-one CAS Name: 5-(4-chlorophenyl)-2-methyl-4-(phenylmethyl)-1,2,4-triazol-3-one IUPAC Name: 4-benzyl-5-(4-chlorophenyl)-2-methyl-1,2,4-triazol-3-one Traditional Name: 4-benzyl-5-(4-chlorophenyl)-2-methyl-1,2,4-triazol-3-one Formula: C16H14ClN3O MolecularWeight: 299.75486

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)N(C(=N1)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)N(C(=N1)C2=CC=C(C=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C16H14ClN3O/c1-19-16(21)20(11-12-5-3-2-4-6-12)15(18-19)13-7-9-14(17)10-8-13/h2-10H,11H2,1H3