[2-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-methylpiperidine-1-carbodithioate

Systemtic Name: [2-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-methylpiperidine-1-carbodithioate Openeye Name: [2-[2-morpholino-5-(trifluoromethyl)anilino]-2-oxo-ethyl] 4-methylpiperidine-1-carbodithioate CAS Name: 4-methyl-1-piperidinecarbodithioic acid [2-[2-(4-morpholinyl)-5-(trifluoromethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-morpholin-4-yl-5-(trifluoromethyl)anilino]-2-oxoethyl] 4-methylpiperidine-1-carbodithioate Traditional Name: 4-methylpiperidine-1-carbodithioic acid [2-keto-2-[2-morpholino-5-(trifluoromethyl)anilino]ethyl] ester Formula: C20H26F3N3O2S2 MolecularWeight: 461.56455

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

Isomeric SMILES

CC1CCN(CC1)C(=S)SCC(=O)NC2=C(C=CC(=C2)C(F)(F)F)N3CCOCC3

InChI

InChI=1S/C20H26F3N3O2S2/c1-14-4-6-26(7-5-14)19(29)30-13-18(27)24-16-12-15(20(21,22)23)2-3-17(16)25-8-10-28-11-9-25/h2-3,12,14H,4-11,13H2,1H3,(H,24,27)