3-(cyclohexylsulfanylmethyl)-N-(2,4,6-trimethylphenyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-(2,4,6-trimethylphenyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-(2,4,6-trimethylphenyl)benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-(2,4,6-trimethylphenyl)-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-(2,4,6-trimethylphenyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-mesityl-coumarilamide Formula: C25H29NO2S MolecularWeight: 407.56826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO2S/c1-16-13-17(2)23(18(3)14-16)26-25(27)24-21(15-29-19-9-5-4-6-10-19)20-11-7-8-12-22(20)28-24/h7-8,11-14,19H,4-6,9-10,15H2,1-3H3,(H,26,27)