N-[(5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[[5-chloro-7-(4-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]-5-isobutyl-isoxazole-3-carboxamide CAS Name: N-[(5-chloro-7-pyridin-4-yl-2,3-dihydrobenzofuran-2-yl)methyl]-5-(2-methylpropyl)-3-isoxazolecarboxamide IUPAC Name: N-[(5-chloro-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-5-(2-methylpropyl)-1,2-oxazole-3-carboxamide Traditional Name: N-[[5-chloro-7-(4-pyridyl)coumaran-2-yl]methyl]-5-isobutyl-isoxazole-3-carboxamide Formula: C22H22ClN3O3 MolecularWeight: 411.88138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=NO1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=CC=NC=C4

Isomeric SMILES

CC(C)CC1=CC(=NO1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=CC=NC=C4

InChI

InChI=1S/C22H22ClN3O3/c1-13(2)7-17-11-20(26-29-17)22(27)25-12-18-9-15-8-16(23)10-19(21(15)28-18)14-3-5-24-6-4-14/h3-6,8,10-11,13,18H,7,9,12H2,1-2H3,(H,25,27)