3-(4-methylpiperazin-1-yl)-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one dihydrochloride

Systemtic Name: 3-(4-methylpiperazin-1-yl)-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one dihydrochloride Openeye Name: 3-(4-methylpiperazin-1-yl)-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one dihydrochloride CAS Name: 3-(4-methyl-1-piperazinyl)-1-[2-(trifluoromethyl)-10-phenothiazinyl]-1-propanone dihydrochloride IUPAC Name: 3-(4-methylpiperazin-1-yl)-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one dihydrochloride Traditional Name: 3-(4-methylpiperazino)-1-[2-(trifluoromethyl)phenothiazin-10-yl]propan-1-one dihydrochloride Formula: C21H24Cl2F3N3OS MolecularWeight: 494.40097

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CCC(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.Cl.Cl

InChI

InChI=1S/C21H22F3N3OS.2ClH/c1-25-10-12-26(13-11-25)9-8-20(28)27-16-4-2-3-5-18(16)29-19-7-6-15(14-17(19)27)21(22,23)24;;/h2-7,14H,8-13H2,1H3;2*1H