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2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole

2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole

Systemtic Name:2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole
Openeye Name:2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole
CAS Name:2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole
IUPAC Name:2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole
Traditional Name:2-[1,4-diazepan-1-yl-[2-(trifluoromethyl)phenyl]methyl]-1,3-benzothiazole
Formula: C20H20F3N3S
MolecularWeight: 391.45311
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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=CC=C2C(F)(F)F)C3=NC4=CC=CC=C4S3


Isomeric SMILES

C1CNCCN(C1)C(C2=CC=CC=C2C(F)(F)F)C3=NC4=CC=CC=C4S3


InChI

InChI=1S/C20H20F3N3S/c21-20(22,23)15-7-2-1-6-14(15)18(26-12-5-10-24-11-13-26)19-25-16-8-3-4-9-17(16)27-19/h1-4,6-9,18,24H,5,10-13H2


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