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

Systemtic Name: 4-[2-oxidanyl-1-phenyl-1-piperazin-1-yl-1-(1,2,4-triazol-1-yl)butan-2-yl]-2-pentan-3-yl-1,2,4-triazol-3-one Openeye Name: 2-(1-ethylpropyl)-4-[1-hydroxy-1-[phenyl-piperazin-1-yl-(1,2,4-triazol-1-yl)methyl]propyl]-1,2,4-triazol-3-one CAS Name: 4-[2-hydroxy-1-phenyl-1-(1-piperazinyl)-1-(1,2,4-triazol-1-yl)butan-2-yl]-2-pentan-3-yl-1,2,4-triazol-3-one IUPAC Name: 4-[2-hydroxy-1-phenyl-1-piperazin-1-yl-1-(1,2,4-triazol-1-yl)butan-2-yl]-2-pentan-3-yl-1,2,4-triazol-3-one Traditional Name: 2-(1-ethylpropyl)-4-[1-hydroxy-1-[phenyl-piperazino-(1,2,4-triazol-1-yl)methyl]propyl]-1,2,4-triazol-3-one Formula: C23H34N8O2 MolecularWeight: 454.56846

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1C(=O)N(C=N1)C(CC)(C(C2=CC=CC=C2)(N3CCNCC3)N4C=NC=N4)O

Isomeric SMILES

CCC(CC)N1C(=O)N(C=N1)C(CC)(C(C2=CC=CC=C2)(N3CCNCC3)N4C=NC=N4)O

InChI

InChI=1S/C23H34N8O2/c1-4-20(5-2)31-21(32)29(18-27-31)22(33,6-3)23(30-17-25-16-26-30,19-10-8-7-9-11-19)28-14-12-24-13-15-28/h7-11,16-18,20,24,33H,4-6,12-15H2,1-3H3