N-(1,3-benzodioxol-5-yl)-N-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butyl]methanesulfonamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-N-[4-(4-methanoylpiperazin-1-yl)-4-oxidanylidene-butyl]methanesulfonamide Openeye Name: N-(1,3-benzodioxol-5-yl)-N-[4-(4-formylpiperazin-1-yl)-4-oxo-butyl]methanesulfonamide CAS Name: N-(1,3-benzodioxol-5-yl)-N-[4-(4-formyl-1-piperazinyl)-4-oxobutyl]methanesulfonamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-N-[4-(4-formylpiperazin-1-yl)-4-oxobutyl]methanesulfonamide Traditional Name: N-(1,3-benzodioxol-5-yl)-N-[4-(4-formylpiperazino)-4-keto-butyl]methanesulfonamide Formula: C17H23N3O6S MolecularWeight: 397.44602

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)C=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CS(=O)(=O)N(CCCC(=O)N1CCN(CC1)C=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H23N3O6S/c1-27(23,24)20(14-4-5-15-16(11-14)26-13-25-15)6-2-3-17(22)19-9-7-18(12-21)8-10-19/h4-5,11-12H,2-3,6-10,13H2,1H3