3-(cyclohexylsulfanylmethyl)-N-[2-oxidanylidene-2-(propylamino)ethyl]-1-benzofuran-2-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

Isomeric SMILES

CCCNC(=O)CNC(=O)C1=C(C2=CC=CC=C2O1)CSC3CCCCC3

InChI

InChI=1S/C21H28N2O3S/c1-2-12-22-19(24)13-23-21(25)20-17(14-27-15-8-4-3-5-9-15)16-10-6-7-11-18(16)26-20/h6-7,10-11,15H,2-5,8-9,12-14H2,1H3,(H,22,24)(H,23,25)