5-chloranyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-chloro-benzofuran-2-carboxamide CAS Name: 5-chloro-N-[[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methyl]-2-benzofurancarboxamide IUPAC Name: N-[(1-benzyl-3,5-dimethylpyrazol-4-yl)methyl]-5-chloro-1-benzofuran-2-carboxamide Traditional Name: N-[(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-chloro-coumarilamide Formula: C22H20ClN3O2 MolecularWeight: 393.8661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C22H20ClN3O2/c1-14-19(15(2)26(25-14)13-16-6-4-3-5-7-16)12-24-22(27)21-11-17-10-18(23)8-9-20(17)28-21/h3-11H,12-13H2,1-2H3,(H,24,27)