N-(2-bromanyl-4-methyl-phenyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-3-(cyclohexylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-(2-bromo-4-methylphenyl)-3-[(cyclohexylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-(2-bromo-4-methylphenyl)-3-(cyclohexylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-3-[(cyclohexylthio)methyl]coumarilamide Formula: C23H24BrNO2S MolecularWeight: 458.41116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC4CCCCC4)Br

InChI

InChI=1S/C23H24BrNO2S/c1-15-11-12-20(19(24)13-15)25-23(26)22-18(14-28-16-7-3-2-4-8-16)17-9-5-6-10-21(17)27-22/h5-6,9-13,16H,2-4,7-8,14H2,1H3,(H,25,26)