2-[(4-methoxyphenyl)methyl]-4-(4-piperazin-1-ylphenyl)-1,2,4-triazol-3-one

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4-(4-piperazin-1-ylphenyl)-1,2,4-triazol-3-one Openeye Name: 2-[(4-methoxyphenyl)methyl]-4-(4-piperazin-1-ylphenyl)-1,2,4-triazol-3-one CAS Name: 2-[(4-methoxyphenyl)methyl]-4-[4-(1-piperazinyl)phenyl]-1,2,4-triazol-3-one IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4-(4-piperazin-1-ylphenyl)-1,2,4-triazol-3-one Traditional Name: 2-p-anisyl-4-(4-piperazinophenyl)-1,2,4-triazol-3-one Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)N(C=N2)C3=CC=C(C=C3)N4CCNCC4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)N(C=N2)C3=CC=C(C=C3)N4CCNCC4

InChI

InChI=1S/C20H23N5O2/c1-27-19-8-2-16(3-9-19)14-25-20(26)24(15-22-25)18-6-4-17(5-7-18)23-12-10-21-11-13-23/h2-9,15,21H,10-14H2,1H3