1-[(5-bromanyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-morpholin-4-yl-pyrazole-3-carboxamide

Systemtic Name: 1-[(5-bromanyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-morpholin-4-yl-pyrazole-3-carboxamide Openeye Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-N-morpholino-pyrazole-3-carboxamide CAS Name: 1-[(5-bromo-2-propan-2-yl-7-benzofuranyl)methyl]-5-methyl-N-(4-morpholinyl)-3-pyrazolecarboxamide IUPAC Name: 1-[(5-bromo-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-morpholin-4-ylpyrazole-3-carboxamide Traditional Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-N-morpholino-pyrazole-3-carboxamide Formula: C21H25BrN4O3 MolecularWeight: 461.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C3C(=CC(=C2)Br)C=C(O3)C(C)C)C(=O)NN4CCOCC4

Isomeric SMILES

CC1=CC(=NN1CC2=C3C(=CC(=C2)Br)C=C(O3)C(C)C)C(=O)NN4CCOCC4

InChI

InChI=1S/C21H25BrN4O3/c1-13(2)19-11-15-9-17(22)10-16(20(15)29-19)12-26-14(3)8-18(23-26)21(27)24-25-4-6-28-7-5-25/h8-11,13H,4-7,12H2,1-3H3,(H,24,27)