3-[(4-bromanyl-2-chloranyl-phenyl)methyl]-N-butylsulfonyl-2-methyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[(4-bromanyl-2-chloranyl-phenyl)methyl]-N-butylsulfonyl-2-methyl-benzimidazole-5-carboxamide Openeye Name: 3-[(4-bromo-2-chloro-phenyl)methyl]-N-butylsulfonyl-2-methyl-benzimidazole-5-carboxamide CAS Name: 3-[(4-bromo-2-chlorophenyl)methyl]-N-butylsulfonyl-2-methyl-5-benzimidazolecarboxamide IUPAC Name: 3-[(4-bromo-2-chlorophenyl)methyl]-N-butylsulfonyl-2-methylbenzimidazole-5-carboxamide Traditional Name: 3-(4-bromo-2-chloro-benzyl)-N-butylsulfonyl-2-methyl-benzimidazole-5-carboxamide Formula: C20H21BrClN3O3S MolecularWeight: 498.82104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)Br)Cl)C

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)Br)Cl)C

InChI

InChI=1S/C20H21BrClN3O3S/c1-3-4-9-29(27,28)24-20(26)14-6-8-18-19(10-14)25(13(2)23-18)12-15-5-7-16(21)11-17(15)22/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,24,26)