6-tert-butyl-2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 6-tert-butyl-2-[2,2,3,3,4,4,4-heptakis(fluoranyl)butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 6-tert-butyl-2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 6-tert-butyl-2-[(2,2,3,3,4,4,4-heptafluoro-1-oxobutyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 6-tert-butyl-2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 6-tert-butyl-2-(2,2,3,3,4,4,4-heptafluorobutanoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C17H19F7N2O2S MolecularWeight: 448.398782

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

InChI

InChI=1S/C17H19F7N2O2S/c1-14(2,3)7-4-5-8-9(6-7)29-12(10(8)11(25)27)26-13(28)15(18,19)16(20,21)17(22,23)24/h7H,4-6H2,1-3H3,(H2,25,27)(H,26,28)