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

Systemtic Name: 4-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]methyl]-2-pentan-3-yl-1,2,4-triazol-3-one Openeye Name: 2-(1-ethylpropyl)-4-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]methyl]-1,2,4-triazol-3-one CAS Name: 4-[[4-[4-(4-methoxyphenyl)-1-piperazinyl]phenyl]methyl]-2-pentan-3-yl-1,2,4-triazol-3-one IUPAC Name: 4-[[4-[4-(4-methoxyphenyl)piperazin-1-yl]phenyl]methyl]-2-pentan-3-yl-1,2,4-triazol-3-one Traditional Name: 2-(1-ethylpropyl)-4-[4-[4-(4-methoxyphenyl)piperazino]benzyl]-1,2,4-triazol-3-one Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)N(C=N1)CC2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CCC(CC)N1C(=O)N(C=N1)CC2=CC=C(C=C2)N3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H33N5O2/c1-4-21(5-2)30-25(31)29(19-26-30)18-20-6-8-22(9-7-20)27-14-16-28(17-15-27)23-10-12-24(32-3)13-11-23/h6-13,19,21H,4-5,14-18H2,1-3H3