2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-ethyl-N-[2-(ethylamino)-2-oxidanylidene-ethyl]ethanamide

Systemtic Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-ethyl-N-[2-(ethylamino)-2-oxidanylidene-ethyl]ethanamide Openeye Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-ethyl-N-[2-(ethylamino)-2-oxo-ethyl]acetamide CAS Name: 2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazin-1-iumyl]-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]acetamide IUPAC Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-ethyl-N-[2-(ethylamino)-2-oxoethyl]acetamide Traditional Name: 2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-ium-1-yl]-N-ethyl-N-[2-(ethylamino)-2-keto-ethyl]acetamide Formula: C20H33N4O4S+ MolecularWeight: 425.56542

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)CN(CC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCNC(=O)CN(CC)C(=O)C[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C20H32N4O4S/c1-5-21-19(25)14-23(6-2)20(26)15-22-9-11-24(12-10-22)29(27,28)18-8-7-16(3)17(4)13-18/h7-8,13H,5-6,9-12,14-15H2,1-4H3,(H,21,25)/p+1