3-[2-fluoranyl-3-(4-phenethylpiperazin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole

Systemtic Name: 3-[2-fluoranyl-3-(4-phenethylpiperazin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Openeye Name: 3-[2-fluoro-3-(4-phenethylpiperazin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole CAS Name: 3-[2-fluoro-3-(4-phenethyl-1-piperazinyl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole IUPAC Name: 3-[2-fluoro-3-(4-phenethylpiperazin-1-yl)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Traditional Name: 3-[2-fluoro-3-(4-phenethylpiperazino)propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Formula: C25H29FN6 MolecularWeight: 432.536363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)CC(CC3=CNC4=C3C=C(C=C4)N5C=NN=C5)F

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)CC(CC3=CNC4=C3C=C(C=C4)N5C=NN=C5)F

InChI

InChI=1S/C25H29FN6/c26-22(17-31-12-10-30(11-13-31)9-8-20-4-2-1-3-5-20)14-21-16-27-25-7-6-23(15-24(21)25)32-18-28-29-19-32/h1-7,15-16,18-19,22,27H,8-14,17H2