2-[4-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]piperazin-1-ium-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[2-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-1-piperazin-1-iumyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]piperazin-1-ium-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[2-[4-(2-fluorophenyl)sulfonylpiperazino]-2-keto-ethyl]piperazin-1-ium-1-yl]acetamide Formula: C21H31FN5O4S+ MolecularWeight: 468.565343

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C[NH+]1CCN(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C=CCNC(=O)C[NH+]1CCN(CC1)CC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H30FN5O4S/c1-2-7-23-20(28)16-24-8-10-25(11-9-24)17-21(29)26-12-14-27(15-13-26)32(30,31)19-6-4-3-5-18(19)22/h2-6H,1,7-17H2,(H,23,28)/p+1