3-(4-methylpiperazin-1-yl)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride

Systemtic Name: 3-(4-methylpiperazin-1-yl)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride Openeye Name: 3-(4-methylpiperazin-1-yl)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride CAS Name: 3-(4-methyl-1-piperazinyl)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride IUPAC Name: 3-(4-methylpiperazin-1-yl)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride Traditional Name: 3-(4-methylpiperazino)-1-propyl-2-(trifluoromethyl)-10H-phenothiazine dihydrochloride Formula: C21H26Cl2F3N3S MolecularWeight: 480.41745

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC2=C1NC3=CC=CC=C3S2)N4CCN(CC4)C)C(F)(F)F.Cl.Cl

Isomeric SMILES

CCCC1=C(C(=CC2=C1NC3=CC=CC=C3S2)N4CCN(CC4)C)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C21H24F3N3S.2ClH/c1-3-6-14-19(21(22,23)24)16(27-11-9-26(2)10-12-27)13-18-20(14)25-15-7-4-5-8-17(15)28-18;;/h4-5,7-8,13,25H,3,6,9-12H2,1-2H3;2*1H