3-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethylsulfonyl]propanamide

Systemtic Name: 3-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethylsulfonyl]propanamide Openeye Name: 3-[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]ethylsulfonyl]propanamide CAS Name: 3-[2-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazin-4-iumyl]ethylsulfonyl]propanamide IUPAC Name: 3-[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-4-ium-1-yl]ethylsulfonyl]propanamide Traditional Name: 3-[2-[4-[(5-chloro-2-thienyl)methyl]piperazin-4-ium-1-yl]ethylsulfonyl]propionamide Formula: C14H23ClN3O3S2+ MolecularWeight: 380.93372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)CCS(=O)(=O)CCC(=O)N

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)CCS(=O)(=O)CCC(=O)N

InChI

InChI=1S/C14H22ClN3O3S2/c15-13-2-1-12(22-13)11-18-6-4-17(5-7-18)8-10-23(20,21)9-3-14(16)19/h1-2H,3-11H2,(H2,16,19)/p+1