1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-2-one

Systemtic Name: 1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-2-one Openeye Name: 1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-2-one CAS Name: 1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]-2-piperazinone IUPAC Name: 1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-2-one Traditional Name: 1-phenethyl-4-[3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperazin-2-one Formula: C25H28N6O MolecularWeight: 428.52942

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1CCCC2=CNC3=C2C=C(C=C3)N4C=NN=C4)CCC5=CC=CC=C5

Isomeric SMILES

C1CN(C(=O)CN1CCCC2=CNC3=C2C=C(C=C3)N4C=NN=C4)CCC5=CC=CC=C5

InChI

InChI=1S/C25H28N6O/c32-25-17-29(13-14-30(25)12-10-20-5-2-1-3-6-20)11-4-7-21-16-26-24-9-8-22(15-23(21)24)31-18-27-28-19-31/h1-3,5-6,8-9,15-16,18-19,26H,4,7,10-14,17H2