2-[2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-methylsulfonylpiperazin-1-ium-1-yl)ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-(4-methylsulfonyl-1-piperazin-1-iumyl)-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-methylsulfonylpiperazin-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-(4-mesylpiperazin-1-ium-1-yl)acetyl]amino]thiophene-3-carboxamide Formula: C12H19N4O4S2+ MolecularWeight: 347.43366

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CS(=O)(=O)N1CC[NH+](CC1)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C12H18N4O4S2/c1-22(19,20)16-5-3-15(4-6-16)8-10(17)14-12-9(11(13)18)2-7-21-12/h2,7H,3-6,8H2,1H3,(H2,13,18)(H,14,17)/p+1