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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=NN(C(=O)N1C2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC)C

InChI

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