3-(cyclohexylsulfanylmethyl)-N-(3-methylbutyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-(3-methylbutyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-isopentyl-benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-(3-methylbutyl)-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-(3-methylbutyl)-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-isoamyl-coumarilamide Formula: C21H29NO2S MolecularWeight: 359.52546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

Isomeric SMILES

CC(C)CCNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

InChI

InChI=1S/C21H29NO2S/c1-15(2)12-13-22-21(23)20-18(14-25-16-8-4-3-5-9-16)17-10-6-7-11-19(17)24-20/h6-7,10-11,15-16H,3-5,8-9,12-14H2,1-2H3,(H,22,23)