10-[3-(4-methylpiperazin-1-yl)propyl]-10-oxidanidyl-2-(trifluoromethyl)phenothiazin-10-ium

Systemtic Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-10-oxidanidyl-2-(trifluoromethyl)phenothiazin-10-ium Openeye Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-10-oxido-2-(trifluoromethyl)phenothiazin-10-ium CAS Name: 10-[3-(4-methyl-1-piperazinyl)propyl]-10-oxido-2-(trifluoromethyl)phenothiazin-10-ium IUPAC Name: 10-[3-(4-methylpiperazin-1-yl)propyl]-10-oxido-2-(trifluoromethyl)phenothiazin-10-ium Traditional Name: 10-[3-(4-methylpiperazino)propyl]-10-oxido-2-(trifluoromethyl)phenothiazin-10-ium Formula: C21H24F3N3OS MolecularWeight: 423.49497

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCC[N+]2(C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)[O-]

Isomeric SMILES

CN1CCN(CC1)CCC[N+]2(C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)[O-]

InChI

InChI=1S/C21H24F3N3OS/c1-25-10-12-26(13-11-25)9-4-14-27(28)17-5-2-3-6-19(17)29-20-8-7-16(15-18(20)27)21(22,23)24/h2-3,5-8,15H,4,9-14H2,1H3