sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate

Systemtic Name: sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate Openeye Name: sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate CAS Name: sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate IUPAC Name: sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate Traditional Name: sodium N-methyl-N-[3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]carbamodithioate Formula: C18H17F3NNaOS2 MolecularWeight: 407.44866

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F)C(=S)[S-].[Na+]

Isomeric SMILES

CN(CCC(C1=CC=CC=C1)OC2=CC=C(C=C2)C(F)(F)F)C(=S)[S-].[Na+]

InChI

InChI=1S/C18H18F3NOS2.Na/c1-22(17(24)25)12-11-16(13-5-3-2-4-6-13)23-15-9-7-14(8-10-15)18(19,20)21;/h2-10,16H,11-12H2,1H3,(H,24,25);/q;+1/p-1