4-[4-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutyl]piperazin-1-yl]-1H-indole

Systemtic Name: 4-[4-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutyl]piperazin-1-yl]-1H-indole Openeye Name: 4-[4-[4-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]butyl]piperazin-1-yl]-1H-indole CAS Name: 4-[4-[4-[[5-(trifluoromethyl)-2-pyridinyl]thio]butyl]-1-piperazinyl]-1H-indole IUPAC Name: 4-[4-[4-[5-(trifluoromethyl)pyridin-2-yl]sulfanylbutyl]piperazin-1-yl]-1H-indole Traditional Name: 4-[4-[4-[[5-(trifluoromethyl)-2-pyridyl]thio]butyl]piperazino]-1H-indole Formula: C22H25F3N4S MolecularWeight: 434.52091

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCSC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC4=C3C=CN4

Isomeric SMILES

C1CN(CCN1CCCCSC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC4=C3C=CN4

InChI

InChI=1S/C22H25F3N4S/c23-22(24,25)17-6-7-21(27-16-17)30-15-2-1-10-28-11-13-29(14-12-28)20-5-3-4-19-18(20)8-9-26-19/h3-9,16,26H,1-2,10-15H2