1-(5-methyl-4-pyridin-4-yl-1,2,4-triazol-3-yl)-2-[4-phenyl-2-(phenylmethyl)piperazin-1-yl]butan-1-ol

Systemtic Name: 1-(5-methyl-4-pyridin-4-yl-1,2,4-triazol-3-yl)-2-[4-phenyl-2-(phenylmethyl)piperazin-1-yl]butan-1-ol Openeye Name: 2-(2-benzyl-4-phenyl-piperazin-1-yl)-1-[5-methyl-4-(4-pyridyl)-1,2,4-triazol-3-yl]butan-1-ol CAS Name: 1-(5-methyl-4-pyridin-4-yl-1,2,4-triazol-3-yl)-2-[4-phenyl-2-(phenylmethyl)-1-piperazinyl]-1-butanol IUPAC Name: 2-(2-benzyl-4-phenylpiperazin-1-yl)-1-(5-methyl-4-pyridin-4-yl-1,2,4-triazol-3-yl)butan-1-ol Traditional Name: 2-(2-benzyl-4-phenyl-piperazino)-1-[5-methyl-4-(4-pyridyl)-1,2,4-triazol-3-yl]butan-1-ol Formula: C29H34N6O MolecularWeight: 482.61986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=NN=C(N1C2=CC=NC=C2)C)O)N3CCN(CC3CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C(C1=NN=C(N1C2=CC=NC=C2)C)O)N3CCN(CC3CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H34N6O/c1-3-27(28(36)29-32-31-22(2)35(29)25-14-16-30-17-15-25)34-19-18-33(24-12-8-5-9-13-24)21-26(34)20-23-10-6-4-7-11-23/h4-17,26-28,36H,3,18-21H2,1-2H3