S-[2-[di(propan-2-yl)amino]ethyl] 9-(trifluoromethyl)pyrido[2,3-b][1,4]benzothiazine-5-carbothioate

Systemtic Name: S-[2-[di(propan-2-yl)amino]ethyl] 9-(trifluoromethyl)pyrido[2,3-b][1,4]benzothiazine-5-carbothioate Openeye Name: S-[2-(diisopropylamino)ethyl] 9-(trifluoromethyl)pyrido[2,3-b][1,4]benzothiazine-5-carbothioate CAS Name: 9-(trifluoromethyl)-5-pyrido[2,3-b][1,4]benzothiazinecarbothioic acid S-[2-[di(propan-2-yl)amino]ethyl] ester IUPAC Name: S-[2-[di(propan-2-yl)amino]ethyl] 9-(trifluoromethyl)pyrido[2,3-b][1,4]benzothiazine-5-carbothioate Traditional Name: 9-(trifluoromethyl)pyrido[2,3-b][1,4]benzothiazine-5-carbothioic acid S-[2-(diisopropylamino)ethyl] ester Formula: C21H24F3N3OS2 MolecularWeight: 455.55997

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCSC(=O)N1C2=C(N=CC=C2)SC3=C(C=CC=C31)C(F)(F)F)C(C)C

Isomeric SMILES

CC(C)N(CCSC(=O)N1C2=C(N=CC=C2)SC3=C(C=CC=C31)C(F)(F)F)C(C)C

InChI

InChI=1S/C21H24F3N3OS2/c1-13(2)26(14(3)4)11-12-29-20(28)27-16-8-5-7-15(21(22,23)24)18(16)30-19-17(27)9-6-10-25-19/h5-10,13-14H,11-12H2,1-4H3