ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine

Systemtic Name: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine Openeye Name: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine CAS Name: ethanol; 1-propyl-3-(9-thioxanthenylidene)-2-(trifluoromethyl)piperazine IUPAC Name: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine Traditional Name: ethanol; 1-propyl-3-thioxanthen-9-ylidene-2-(trifluoromethyl)piperazine Formula: C23H27F3N2OS MolecularWeight: 436.53349

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCNC(=C2C3=CC=CC=C3SC4=CC=CC=C42)C1C(F)(F)F.CCO

Isomeric SMILES

CCCN1CCNC(=C2C3=CC=CC=C3SC4=CC=CC=C42)C1C(F)(F)F.CCO

InChI

InChI=1S/C21H21F3N2S.C2H6O/c1-2-12-26-13-11-25-19(20(26)21(22,23)24)18-14-7-3-5-9-16(14)27-17-10-6-4-8-15(17)18;1-2-3/h3-10,20,25H,2,11-13H2,1H3;3H,2H2,1H3