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

Systemtic Name: 1-[(5-bromanyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-[4-[(4-oxidanylpiperidin-1-yl)methyl]phenyl]pyrazole-4-carboxamide Openeye Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-N-[4-[(4-hydroxy-1-piperidyl)methyl]phenyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-[(5-bromo-2-propan-2-yl-7-benzofuranyl)methyl]-N-[4-[(4-hydroxy-1-piperidinyl)methyl]phenyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-[(5-bromo-2-propan-2-yl-1-benzofuran-7-yl)methyl]-N-[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-N-[4-[(4-hydroxypiperidino)methyl]phenyl]-5-methyl-pyrazole-4-carboxamide Formula: C29H33BrN4O3 MolecularWeight: 565.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1CC2=C3C(=CC(=C2)Br)C=C(O3)C(C)C)C(=O)NC4=CC=C(C=C4)CN5CCC(CC5)O

Isomeric SMILES

CC1=C(C=NN1CC2=C3C(=CC(=C2)Br)C=C(O3)C(C)C)C(=O)NC4=CC=C(C=C4)CN5CCC(CC5)O

InChI

InChI=1S/C29H33BrN4O3/c1-18(2)27-14-21-12-23(30)13-22(28(21)37-27)17-34-19(3)26(15-31-34)29(36)32-24-6-4-20(5-7-24)16-33-10-8-25(35)9-11-33/h4-7,12-15,18,25,35H,8-11,16-17H2,1-3H3,(H,32,36)