N-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-1,3-benzothiazol-2-amine Openeye Name: N-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-1,3-benzothiazol-2-amine CAS Name: N-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]propyl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-[3-[4-[3-(trifluoromethyl)phenyl]piperazino]propyl]amine Formula: C21H23F3N4S MolecularWeight: 420.49433

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC2=NC3=CC=CC=C3S2)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCCNC2=NC3=CC=CC=C3S2)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C21H23F3N4S/c22-21(23,24)16-5-3-6-17(15-16)28-13-11-27(12-14-28)10-4-9-25-20-26-18-7-1-2-8-19(18)29-20/h1-3,5-8,15H,4,9-14H2,(H,25,26)