N-tert-butyl-5-methyl-1-[(5-methylsulfonyl-2-phenyl-1-benzofuran-7-yl)methyl]pyrazole-3-carboxamide

Systemtic Name: N-tert-butyl-5-methyl-1-[(5-methylsulfonyl-2-phenyl-1-benzofuran-7-yl)methyl]pyrazole-3-carboxamide Openeye Name: N-tert-butyl-5-methyl-1-[(5-methylsulfonyl-2-phenyl-benzofuran-7-yl)methyl]pyrazole-3-carboxamide CAS Name: N-tert-butyl-5-methyl-1-[(5-methylsulfonyl-2-phenyl-7-benzofuranyl)methyl]-3-pyrazolecarboxamide IUPAC Name: N-tert-butyl-5-methyl-1-[(5-methylsulfonyl-2-phenyl-1-benzofuran-7-yl)methyl]pyrazole-3-carboxamide Traditional Name: N-tert-butyl-1-[(5-mesyl-2-phenyl-benzofuran-7-yl)methyl]-5-methyl-pyrazole-3-carboxamide Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=C3C(=CC(=C2)S(=O)(=O)C)C=C(O3)C4=CC=CC=C4)C(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=NN1CC2=C3C(=CC(=C2)S(=O)(=O)C)C=C(O3)C4=CC=CC=C4)C(=O)NC(C)(C)C

InChI

InChI=1S/C25H27N3O4S/c1-16-11-21(24(29)26-25(2,3)4)27-28(16)15-19-13-20(33(5,30)31)12-18-14-22(32-23(18)19)17-9-7-6-8-10-17/h6-14H,15H2,1-5H3,(H,26,29)