1-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-2-(3-tert-butylphenoxy)propan-1-one

Systemtic Name: 1-[4-(3H-benzimidazol-5-ylcarbonyl)piperazin-1-yl]-2-(3-tert-butylphenoxy)propan-1-one Openeye Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-2-(3-tert-butylphenoxy)propan-1-one CAS Name: 1-[4-[3H-benzimidazol-5-yl(oxo)methyl]-1-piperazinyl]-2-(3-tert-butylphenoxy)-1-propanone IUPAC Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazin-1-yl]-2-(3-tert-butylphenoxy)propan-1-one Traditional Name: 1-[4-(3H-benzimidazole-5-carbonyl)piperazino]-2-(3-tert-butylphenoxy)propan-1-one Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3)OC4=CC=CC(=C4)C(C)(C)C

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=CN3)OC4=CC=CC(=C4)C(C)(C)C

InChI

InChI=1S/C25H30N4O3/c1-17(32-20-7-5-6-19(15-20)25(2,3)4)23(30)28-10-12-29(13-11-28)24(31)18-8-9-21-22(14-18)27-16-26-21/h5-9,14-17H,10-13H2,1-4H3,(H,26,27)