3-[3-[4-[(4-fluorophenyl)methylsulfinyl]piperidin-1-yl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole

Systemtic Name: 3-[3-[4-[(4-fluorophenyl)methylsulfinyl]piperidin-1-yl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Openeye Name: 3-[3-[4-[(4-fluorophenyl)methylsulfinyl]-1-piperidyl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole CAS Name: 3-[3-[4-[(4-fluorophenyl)methylsulfinyl]-1-piperidinyl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole IUPAC Name: 3-[3-[4-[(4-fluorophenyl)methylsulfinyl]piperidin-1-yl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Traditional Name: 3-[3-[4-(4-fluorobenzyl)sulfinylpiperidino]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole Formula: C25H28FN5OS MolecularWeight: 465.586123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1S(=O)CC2=CC=C(C=C2)F)CCCC3=CNC4=C3C=C(C=C4)N5C=NN=C5

Isomeric SMILES

C1CN(CCC1S(=O)CC2=CC=C(C=C2)F)CCCC3=CNC4=C3C=C(C=C4)N5C=NN=C5

InChI

InChI=1S/C25H28FN5OS/c26-21-5-3-19(4-6-21)16-33(32)23-9-12-30(13-10-23)11-1-2-20-15-27-25-8-7-22(14-24(20)25)31-17-28-29-18-31/h3-8,14-15,17-18,23,27H,1-2,9-13,16H2