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

Systemtic Name: 3-[[3-bromanyl-2-[2-(phenylsulfonylcarbamoyl)phenyl]-1-benzofuran-5-yl]methyl]-5-chloranyl-2-ethyl-imidazole-4-carboxamide Openeye Name: 3-[[2-[2-(benzenesulfonylcarbamoyl)phenyl]-3-bromo-benzofuran-5-yl]methyl]-5-chloro-2-ethyl-imidazole-4-carboxamide CAS Name: 3-[[2-[2-[benzenesulfonamido(oxo)methyl]phenyl]-3-bromo-5-benzofuranyl]methyl]-5-chloro-2-ethyl-4-imidazolecarboxamide IUPAC Name: 3-[[2-[2-(benzenesulfonylcarbamoyl)phenyl]-3-bromo-1-benzofuran-5-yl]methyl]-5-chloro-2-ethylimidazole-4-carboxamide Traditional Name: 3-[[2-[2-(besylcarbamoyl)phenyl]-3-bromo-benzofuran-5-yl]methyl]-5-chloro-2-ethyl-imidazole-4-carboxamide Formula: C28H22BrClN4O5S MolecularWeight: 641.92008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)NS(=O)(=O)C5=CC=CC=C5)C(=O)N)Cl

Isomeric SMILES

CCC1=NC(=C(N1CC2=CC3=C(C=C2)OC(=C3Br)C4=CC=CC=C4C(=O)NS(=O)(=O)C5=CC=CC=C5)C(=O)N)Cl

InChI

InChI=1S/C28H22BrClN4O5S/c1-2-22-32-26(30)24(27(31)35)34(22)15-16-12-13-21-20(14-16)23(29)25(39-21)18-10-6-7-11-19(18)28(36)33-40(37,38)17-8-4-3-5-9-17/h3-14H,2,15H2,1H3,(H2,31,35)(H,33,36)