10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine sulfate

Systemtic Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine sulfate Openeye Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine sulfate CAS Name: 10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)phenothiazine sulfate IUPAC Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine sulfate Traditional Name: 10-[3-(4-methylpiperazino)propyl]-2-(trifluoromethyl)phenothiazine sulfate Formula: C21H24F3N3O4S2-2 MolecularWeight: 503.55817

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C21H24F3N3S.H2O4S/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24;1-5(2,3)4/h2-3,5-8,15H,4,9-14H2,1H3;(H2,1,2,3,4)/p-2