3-(cyclohexylsulfanylmethyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[1-(4-methylsulfonylphenyl)ethyl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[1-(4-methylsulfonylphenyl)ethyl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[1-(4-methylsulfonylphenyl)ethyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[1-(4-mesylphenyl)ethyl]coumarilamide Formula: C25H29NO4S2 MolecularWeight: 471.63206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO4S2/c1-17(18-12-14-20(15-13-18)32(2,28)29)26-25(27)24-22(16-31-19-8-4-3-5-9-19)21-10-6-7-11-23(21)30-24/h6-7,10-15,17,19H,3-5,8-9,16H2,1-2H3,(H,26,27)