N-[2,6-bis(chloranyl)phenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2,6-bis(chloranyl)phenyl]-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,6-dichlorophenyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dichlorophenyl)-2-(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(2,6-dichlorophenyl)-2-(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(2,6-dichlorophenyl)-2-[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]acetamide Formula: C16H18Cl2N3O3S2+ MolecularWeight: 435.36842

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C=CC=C2Cl)Cl)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C=CC=C2Cl)Cl)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H17Cl2N3O3S2/c17-12-3-1-4-13(18)16(12)19-14(22)11-20-6-8-21(9-7-20)26(23,24)15-5-2-10-25-15/h1-5,10H,6-9,11H2,(H,19,22)/p+1