10-[(2,2,5,5-tetramethyl-1-oxidanyl-pyrrol-3-yl)methyl]-2-(trifluoromethyl)phenothiazine

Systemtic Name: 10-[(2,2,5,5-tetramethyl-1-oxidanyl-pyrrol-3-yl)methyl]-2-(trifluoromethyl)phenothiazine Openeye Name: 10-[(1-hydroxy-2,2,5,5-tetramethyl-pyrrol-3-yl)methyl]-2-(trifluoromethyl)phenothiazine CAS Name: 10-[(1-hydroxy-2,2,5,5-tetramethyl-3-pyrrolyl)methyl]-2-(trifluoromethyl)phenothiazine IUPAC Name: 10-[(1-hydroxy-2,2,5,5-tetramethylpyrrol-3-yl)methyl]-2-(trifluoromethyl)phenothiazine Traditional Name: 10-[(1-hydroxy-2,2,5,5-tetramethyl-3-pyrrolin-3-yl)methyl]-2-(trifluoromethyl)phenothiazine Formula: C22H23F3N2OS MolecularWeight: 420.49103

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C(N1O)(C)C)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C

Isomeric SMILES

CC1(C=C(C(N1O)(C)C)CN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F)C

InChI

InChI=1S/C22H23F3N2OS/c1-20(2)12-15(21(3,4)27(20)28)13-26-16-7-5-6-8-18(16)29-19-10-9-14(11-17(19)26)22(23,24)25/h5-12,28H,13H2,1-4H3