5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione

Systemtic Name: 5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione Openeye Name: 5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione CAS Name: 5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione IUPAC Name: 5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione Traditional Name: 5-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]-1,3,5-triazinane-2-thione Formula: C19H20F3N3S MolecularWeight: 379.44241

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)N(CN1CCCC2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

C1NC(=S)N(CN1CCCC2=CC=CC=C2)C3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3S/c20-19(21,22)16-9-4-10-17(12-16)25-14-24(13-23-18(25)26)11-5-8-15-6-2-1-3-7-15/h1-4,6-7,9-10,12H,5,8,11,13-14H2,(H,23,26)