4-[4-[4-(4-chlorophenyl)piperazin-1-yl]phenyl]-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]phenyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]phenyl]-1H-1,2,4-triazol-5-one CAS Name: 4-[4-[4-(4-chlorophenyl)-1-piperazinyl]phenyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-[4-[4-(4-chlorophenyl)piperazin-1-yl]phenyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-[4-(4-chlorophenyl)piperazino]phenyl]-1H-1,2,4-triazol-5-one Formula: C18H18ClN5O MolecularWeight: 355.82142

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)N3C=NNC3=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)N3C=NNC3=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H18ClN5O/c19-14-1-3-15(4-2-14)22-9-11-23(12-10-22)16-5-7-17(8-6-16)24-13-20-21-18(24)25/h1-8,13H,9-12H2,(H,21,25)