N-(4-tert-butylphenyl)-2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(4-tert-butylphenyl)-2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(4-tert-butylphenyl)-2-(2,3-dihydrobenzofuran-5-ylmethylamino)pyridine-3-carboxamide CAS Name: N-(4-tert-butylphenyl)-2-(2,3-dihydrobenzofuran-5-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(4-tert-butylphenyl)-2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(4-tert-butylphenyl)-2-(coumaran-5-ylmethylamino)nicotinamide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)NCC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C25H27N3O2/c1-25(2,3)19-7-9-20(10-8-19)28-24(29)21-5-4-13-26-23(21)27-16-17-6-11-22-18(15-17)12-14-30-22/h4-11,13,15H,12,14,16H2,1-3H3,(H,26,27)(H,28,29)