5-tert-butyl-N-(2-pyridin-2-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-(2-pyridin-2-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-[2-(2-pyridyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[2-(2-pyridinyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-(2-pyridin-2-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-[2-(2-pyridyl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCCC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCCC3=CC=CC=N3

InChI

InChI=1S/C20H26N2OS/c1-20(2,3)15-7-8-17-14(12-15)13-18(24-17)19(23)22-11-9-16-6-4-5-10-21-16/h4-6,10,13,15H,7-9,11-12H2,1-3H3,(H,22,23)