2-butan-2-yl-4-[4-[4-(3,5-dimethyl-4-oxidanyl-phenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one

Systemtic Name: 2-butan-2-yl-4-[4-[4-(3,5-dimethyl-4-oxidanyl-phenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one Openeye Name: 4-[4-[4-(4-hydroxy-3,5-dimethyl-phenyl)piperazin-1-yl]phenyl]-5-methyl-2-sec-butyl-1,2,4-triazol-3-one CAS Name: 2-butan-2-yl-4-[4-[4-(4-hydroxy-3,5-dimethylphenyl)-1-piperazinyl]phenyl]-5-methyl-1,2,4-triazol-3-one IUPAC Name: 2-butan-2-yl-4-[4-[4-(4-hydroxy-3,5-dimethylphenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one Traditional Name: 4-[4-[4-(4-hydroxy-3,5-dimethyl-phenyl)piperazino]phenyl]-5-methyl-2-sec-butyl-1,2,4-triazol-3-one Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)N(C(=N1)C)C2=CC=C(C=C2)N3CCN(CC3)C4=CC(=C(C(=C4)C)O)C

Isomeric SMILES

CCC(C)N1C(=O)N(C(=N1)C)C2=CC=C(C=C2)N3CCN(CC3)C4=CC(=C(C(=C4)C)O)C

InChI

InChI=1S/C25H33N5O2/c1-6-19(4)30-25(32)29(20(5)26-30)22-9-7-21(8-10-22)27-11-13-28(14-12-27)23-15-17(2)24(31)18(3)16-23/h7-10,15-16,19,31H,6,11-14H2,1-5H3