1-(5-chloranylthiophen-2-yl)sulfonyl-4-(pyridin-4-ylmethyl)piperazin-4-ium

Systemtic Name: 1-(5-chloranylthiophen-2-yl)sulfonyl-4-(pyridin-4-ylmethyl)piperazin-4-ium Openeye Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-(4-pyridylmethyl)piperazin-4-ium CAS Name: 1-[(5-chloro-2-thiophenyl)sulfonyl]-4-(pyridin-4-ylmethyl)piperazin-4-ium IUPAC Name: 1-(5-chlorothiophen-2-yl)sulfonyl-4-(pyridin-4-ylmethyl)piperazin-4-ium Traditional Name: 1-[(5-chloro-2-thienyl)sulfonyl]-4-(4-pyridylmethyl)piperazin-4-ium Formula: C14H17ClN3O2S2+ MolecularWeight: 358.88668

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=NC=C2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C14H16ClN3O2S2/c15-13-1-2-14(21-13)22(19,20)18-9-7-17(8-10-18)11-12-3-5-16-6-4-12/h1-6H,7-11H2/p+1