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

Systemtic Name: 4-[4-(4-methoxyphenyl)-2-piperazin-1-yl-phenyl]-1H-1,2,4-triazol-5-one Openeye Name: 4-[4-(4-methoxyphenyl)-2-piperazin-1-yl-phenyl]-1H-1,2,4-triazol-5-one CAS Name: 4-[4-(4-methoxyphenyl)-2-(1-piperazinyl)phenyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-[4-(4-methoxyphenyl)-2-piperazin-1-ylphenyl]-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-(4-methoxyphenyl)-2-piperazino-phenyl]-1H-1,2,4-triazol-5-one Formula: C19H21N5O2 MolecularWeight: 351.40234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C(C=C2)N3C=NNC3=O)N4CCNCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=C(C=C2)N3C=NNC3=O)N4CCNCC4

InChI

InChI=1S/C19H21N5O2/c1-26-16-5-2-14(3-6-16)15-4-7-17(24-13-21-22-19(24)25)18(12-15)23-10-8-20-9-11-23/h2-7,12-13,20H,8-11H2,1H3,(H,22,25)