N-prop-2-enyl-4-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-prop-2-enyl-4-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-allyl-4-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide CAS Name: 4-[oxo-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazin-4-iumyl]methyl]-N-prop-2-enylbenzenesulfonamide IUPAC Name: N-prop-2-enyl-4-[4-[(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide Traditional Name: N-allyl-4-[4-[[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-carbonyl]benzenesulfonamide Formula: C21H24N5O4S2+ MolecularWeight: 474.57636

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)N2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C21H23N5O4S2/c1-2-9-22-32(28,29)17-7-5-16(6-8-17)21(27)26-12-10-25(11-13-26)15-19-23-20(24-30-19)18-4-3-14-31-18/h2-8,14,22H,1,9-13,15H2/p+1