3-(cyclohexylsulfanylmethyl)-N-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-[1-(ethylamino)-1-oxidanylidene-propan-2-yl]-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[2-(ethylamino)-1-methyl-2-oxo-ethyl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[1-(ethylamino)-1-oxopropan-2-yl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[1-(ethylamino)-1-oxopropan-2-yl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[2-(ethylamino)-2-keto-1-methyl-ethyl]coumarilamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3S/c1-3-22-20(24)14(2)23-21(25)19-17(13-27-15-9-5-4-6-10-15)16-11-7-8-12-18(16)26-19/h7-8,11-12,14-15H,3-6,9-10,13H2,1-2H3,(H,22,24)(H,23,25)