5-(2-methoxyphenyl)-2-(3-methylbutan-2-yl)-4-(2-piperazin-1-ylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 5-(2-methoxyphenyl)-2-(3-methylbutan-2-yl)-4-(2-piperazin-1-ylphenyl)-1,2,4-triazol-3-one Openeye Name: 2-(1,2-dimethylpropyl)-5-(2-methoxyphenyl)-4-(2-piperazin-1-ylphenyl)-1,2,4-triazol-3-one CAS Name: 5-(2-methoxyphenyl)-2-(3-methylbutan-2-yl)-4-[2-(1-piperazinyl)phenyl]-1,2,4-triazol-3-one IUPAC Name: 5-(2-methoxyphenyl)-2-(3-methylbutan-2-yl)-4-(2-piperazin-1-ylphenyl)-1,2,4-triazol-3-one Traditional Name: 2-(1,2-dimethylpropyl)-5-(2-methoxyphenyl)-4-(2-piperazinophenyl)-1,2,4-triazol-3-one Formula: C24H31N5O2 MolecularWeight: 421.53524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)N1C(=O)N(C(=N1)C2=CC=CC=C2OC)C3=CC=CC=C3N4CCNCC4

Isomeric SMILES

CC(C)C(C)N1C(=O)N(C(=N1)C2=CC=CC=C2OC)C3=CC=CC=C3N4CCNCC4

InChI

InChI=1S/C24H31N5O2/c1-17(2)18(3)29-24(30)28(23(26-29)19-9-5-8-12-22(19)31-4)21-11-7-6-10-20(21)27-15-13-25-14-16-27/h5-12,17-18,25H,13-16H2,1-4H3