10-(3-piperazine-1,4-diium-1-ylpropyl)-2-(trifluoromethyl)phenothiazine

Systemtic Name: 10-(3-piperazine-1,4-diium-1-ylpropyl)-2-(trifluoromethyl)phenothiazine Openeye Name: 10-(3-piperazine-1,4-diium-1-ylpropyl)-2-(trifluoromethyl)phenothiazine CAS Name: 10-[3-(1-piperazine-1,4-diiumyl)propyl]-2-(trifluoromethyl)phenothiazine IUPAC Name: 10-(3-piperazine-1,4-diium-1-ylpropyl)-2-(trifluoromethyl)phenothiazine Traditional Name: 10-(3-piperazine-1,4-diium-1-ylpropyl)-2-(trifluoromethyl)phenothiazine Formula: C20H24F3N3S+2 MolecularWeight: 395.48487

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH2+]1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

Isomeric SMILES

C1C[NH+](CC[NH2+]1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F

InChI

InChI=1S/C20H22F3N3S/c21-20(22,23)15-6-7-19-17(14-15)26(16-4-1-2-5-18(16)27-19)11-3-10-25-12-8-24-9-13-25/h1-2,4-7,14,24H,3,8-13H2/p+2