1-(5-chloranylthiophen-2-yl)sulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-4-[5-(1-pyrrolidinylsulfonyl)-2-pyridin-1-iumyl]piperazine IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-4-(5-pyrrolidin-1-ylsulfonylpyridin-1-ium-2-yl)piperazine Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-(5-pyrrolidinosulfonylpyridin-1-ium-2-yl)piperazine Formula: C17H22ClN4O4S3+ MolecularWeight: 478.02898

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C[NH+]=C(C=C2)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H21ClN4O4S3/c18-15-4-6-17(27-15)29(25,26)22-11-9-20(10-12-22)16-5-3-14(13-19-16)28(23,24)21-7-1-2-8-21/h3-6,13H,1-2,7-12H2/p+1