1-[2,5-bis(chloranyl)thiophen-3-yl]sulfonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[2,5-bis(chloranyl)thiophen-3-yl]sulfonyl-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide Openeye Name: 1-[(2,5-dichloro-3-thienyl)sulfonyl]-4-piperidin-1-ium-1-yl-piperidine-4-carboxamide CAS Name: 1-[(2,5-dichloro-3-thiophenyl)sulfonyl]-4-(1-piperidin-1-iumyl)-4-piperidinecarboxamide IUPAC Name: 1-(2,5-dichlorothiophen-3-yl)sulfonyl-4-piperidin-1-ium-1-ylpiperidine-4-carboxamide Traditional Name: 1-[(2,5-dichloro-3-thienyl)sulfonyl]-4-piperidin-1-ium-1-yl-isonipecotamide Formula: C15H22Cl2N3O3S2+ MolecularWeight: 427.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)C2(CCN(CC2)S(=O)(=O)C3=C(SC(=C3)Cl)Cl)C(=O)N

Isomeric SMILES

C1CC[NH+](CC1)C2(CCN(CC2)S(=O)(=O)C3=C(SC(=C3)Cl)Cl)C(=O)N

InChI

InChI=1S/C15H21Cl2N3O3S2/c16-12-10-11(13(17)24-12)25(22,23)20-8-4-15(5-9-20,14(18)21)19-6-2-1-3-7-19/h10H,1-9H2,(H2,18,21)/p+1