2-ethyl-4-[4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one

Systemtic Name: 2-ethyl-4-[4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one Openeye Name: 2-ethyl-4-[4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one CAS Name: 2-ethyl-4-[4-[4-(4-hydroxyphenyl)-1-piperazinyl]phenyl]-5-methyl-1,2,4-triazol-3-one IUPAC Name: 2-ethyl-4-[4-[4-(4-hydroxyphenyl)piperazin-1-yl]phenyl]-5-methyl-1,2,4-triazol-3-one Traditional Name: 2-ethyl-4-[4-[4-(4-hydroxyphenyl)piperazino]phenyl]-5-methyl-1,2,4-triazol-3-one Formula: C21H25N5O2 MolecularWeight: 379.4555

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)N(C(=N1)C)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

CCN1C(=O)N(C(=N1)C)C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H25N5O2/c1-3-25-21(28)26(16(2)22-25)19-6-4-17(5-7-19)23-12-14-24(15-13-23)18-8-10-20(27)11-9-18/h4-11,27H,3,12-15H2,1-2H3