N-[2-(4-butanoylpiperazin-1-yl)-2-oxidanylidene-1-(phenylsulfonyl)ethyl]furan-2-carboxamide

Systemtic Name: N-[2-(4-butanoylpiperazin-1-yl)-2-oxidanylidene-1-(phenylsulfonyl)ethyl]furan-2-carboxamide Openeye Name: N-[1-(benzenesulfonyl)-2-(4-butanoylpiperazin-1-yl)-2-oxo-ethyl]furan-2-carboxamide CAS Name: N-[1-(benzenesulfonyl)-2-oxo-2-[4-(1-oxobutyl)-1-piperazinyl]ethyl]-2-furancarboxamide IUPAC Name: N-[1-(benzenesulfonyl)-2-(4-butanoylpiperazin-1-yl)-2-oxoethyl]furan-2-carboxamide Traditional Name: N-[1-besyl-2-(4-butyrylpiperazino)-2-keto-ethyl]-2-furamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C(=O)C(NC(=O)C2=CC=CO2)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H25N3O6S/c1-2-7-18(25)23-11-13-24(14-12-23)21(27)20(22-19(26)17-10-6-15-30-17)31(28,29)16-8-4-3-5-9-16/h3-6,8-10,15,20H,2,7,11-14H2,1H3,(H,22,26)