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

Systemtic Name: 4-[(3-chlorophenyl)-quinolin-4-yl-methyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-[(3-chlorophenyl)-(4-quinolyl)methyl]-1H-1,2,4-triazol-5-one CAS Name: 4-[(3-chlorophenyl)-(4-quinolinyl)methyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-[(3-chlorophenyl)-quinolin-4-ylmethyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-[(3-chlorophenyl)-(4-quinolyl)methyl]-1H-1,2,4-triazol-5-one Formula: C18H13ClN4O MolecularWeight: 336.77502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)C(C3=CC(=CC=C3)Cl)N4C=NNC4=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)C(C3=CC(=CC=C3)Cl)N4C=NNC4=O

InChI

InChI=1S/C18H13ClN4O/c19-13-5-3-4-12(10-13)17(23-11-21-22-18(23)24)15-8-9-20-16-7-2-1-6-14(15)16/h1-11,17H,(H,22,24)