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

Systemtic Name: 1-[(5-bromanyl-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide Openeye Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide CAS Name: 1-[(5-bromo-2-propan-2-yl-7-benzofuranyl)methyl]-5-methyl-N-[4-(1-pyrrolidinylmethyl)phenyl]-4-pyrazolecarboxamide IUPAC Name: 1-[(5-bromo-2-propan-2-yl-1-benzofuran-7-yl)methyl]-5-methyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrazole-4-carboxamide Traditional Name: 1-[(5-bromo-2-isopropyl-benzofuran-7-yl)methyl]-5-methyl-N-[4-(pyrrolidinomethyl)phenyl]pyrazole-4-carboxamide Formula: C28H31BrN4O2 MolecularWeight: 535.47534

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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)CN5CCCC5

Isomeric SMILES

CC1=C(C=NN1CC2=C3C(=CC(=C2)Br)C=C(O3)C(C)C)C(=O)NC4=CC=C(C=C4)CN5CCCC5

InChI

InChI=1S/C28H31BrN4O2/c1-18(2)26-14-21-12-23(29)13-22(27(21)35-26)17-33-19(3)25(15-30-33)28(34)31-24-8-6-20(7-9-24)16-32-10-4-5-11-32/h6-9,12-15,18H,4-5,10-11,16-17H2,1-3H3,(H,31,34)