S-ethyl 5-methyl-1-pentyl-2-(trifluoromethyl)pyrrole-3-carbothioate

Systemtic Name: S-ethyl 5-methyl-1-pentyl-2-(trifluoromethyl)pyrrole-3-carbothioate Openeye Name: S-ethyl 5-methyl-1-pentyl-2-(trifluoromethyl)pyrrole-3-carbothioate CAS Name: 5-methyl-1-pentyl-2-(trifluoromethyl)-3-pyrrolecarbothioic acid S-ethyl ester IUPAC Name: S-ethyl 5-methyl-1-pentyl-2-(trifluoromethyl)pyrrole-3-carbothioate Traditional Name: 1-amyl-5-methyl-2-(trifluoromethyl)pyrrole-3-carbothioic acid S-ethyl ester Formula: C14H20F3NOS MolecularWeight: 307.37491

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=CC(=C1C(F)(F)F)C(=O)SCC)C

Isomeric SMILES

CCCCCN1C(=CC(=C1C(F)(F)F)C(=O)SCC)C

InChI

InChI=1S/C14H20F3NOS/c1-4-6-7-8-18-10(3)9-11(13(19)20-5-2)12(18)14(15,16)17/h9H,4-8H2,1-3H3