5-tert-butyl-N-(6-imidazol-1-ylpyridin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Systemtic Name: 5-tert-butyl-N-(6-imidazol-1-ylpyridin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Openeye Name: 5-tert-butyl-N-(6-imidazol-1-yl-3-pyridyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide CAS Name: 5-tert-butyl-N-[6-(1-imidazolyl)-3-pyridinyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide IUPAC Name: 5-tert-butyl-N-(6-imidazol-1-ylpyridin-3-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide Traditional Name: 5-tert-butyl-N-(6-imidazol-1-yl-3-pyridyl)-4,5,6,7-tetrahydrobenzothiophene-2-carboxamide Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC(C)(C)C1CCC2=C(C1)C=C(S2)C(=O)NC3=CN=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C21H24N4OS/c1-21(2,3)15-4-6-17-14(10-15)11-18(27-17)20(26)24-16-5-7-19(23-12-16)25-9-8-22-13-25/h5,7-9,11-13,15H,4,6,10H2,1-3H3,(H,24,26)