5-tert-butyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-(3-pyridinylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-(pyridin-3-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-(3-pyridylmethyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C19H24N2OS MolecularWeight: 328.47166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C19H24N2OS/c1-19(2,3)15-6-7-16-14(9-15)10-17(23-16)18(22)21-12-13-5-4-8-20-11-13/h4-5,8,10-11,15H,6-7,9,12H2,1-3H3,(H,21,22)