2-[4-[2-[[3-(diethylsulfamoyl)-4-methyl-phenyl]amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[2-[[3-(diethylsulfamoyl)-4-methyl-phenyl]amino]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[2-[3-(diethylsulfamoyl)-4-methyl-anilino]-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-[3-(diethylsulfamoyl)-4-methylanilino]-2-oxoethyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[2-[3-(diethylsulfamoyl)-4-methylanilino]-2-oxoethyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[2-[3-(diethylsulfamoyl)-4-methyl-anilino]-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C22H36N5O4S+ MolecularWeight: 466.61734

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CN2CC[NH+](CC2)CC(=O)NCC=C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)CN2CC[NH+](CC2)CC(=O)NCC=C)C

InChI

InChI=1S/C22H35N5O4S/c1-5-10-23-21(28)16-25-11-13-26(14-12-25)17-22(29)24-19-9-8-18(4)20(15-19)32(30,31)27(6-2)7-3/h5,8-9,15H,1,6-7,10-14,16-17H2,2-4H3,(H,23,28)(H,24,29)/p+1