3-[[3-bromanyl-2-[2-(phenylsulfonylcarbamoyl)phenyl]-1-benzofuran-5-yl]methyl]-N-ethyl-5-methyl-2-propyl-imidazole-4-carboxamide

Systemtic Name: 3-[[3-bromanyl-2-[2-(phenylsulfonylcarbamoyl)phenyl]-1-benzofuran-5-yl]methyl]-N-ethyl-5-methyl-2-propyl-imidazole-4-carboxamide Openeye Name: 3-[[2-[2-(benzenesulfonylcarbamoyl)phenyl]-3-bromo-benzofuran-5-yl]methyl]-N-ethyl-5-methyl-2-propyl-imidazole-4-carboxamide CAS Name: 3-[[2-[2-[benzenesulfonamido(oxo)methyl]phenyl]-3-bromo-5-benzofuranyl]methyl]-N-ethyl-5-methyl-2-propyl-4-imidazolecarboxamide IUPAC Name: 3-[[2-[2-(benzenesulfonylcarbamoyl)phenyl]-3-bromo-1-benzofuran-5-yl]methyl]-N-ethyl-5-methyl-2-propylimidazole-4-carboxamide Traditional Name: 3-[[2-[2-(besylcarbamoyl)phenyl]-3-bromo-benzofuran-5-yl]methyl]-N-ethyl-5-methyl-2-propyl-imidazole-4-carboxamide Formula: C32H31BrN4O5S MolecularWeight: 663.58134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)NS(=O)(=O)C5=CC=CC=C5)C(=O)NCC)C

Isomeric SMILES

CCCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)NS(=O)(=O)C5=CC=CC=C5)C(=O)NCC)C

InChI

InChI=1S/C32H31BrN4O5S/c1-4-11-27-35-20(3)29(32(39)34-5-2)37(27)19-21-16-17-26-25(18-21)28(33)30(42-26)23-14-9-10-15-24(23)31(38)36-43(40,41)22-12-7-6-8-13-22/h6-10,12-18H,4-5,11,19H2,1-3H3,(H,34,39)(H,36,38)