N-[2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethylamino]-2-oxidanylidene-ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethylamino]-2-oxo-ethyl]thiophene-2-carboxamide CAS Name: N-[2-[2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]ethylamino]-2-oxoethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethylamino]-2-oxoethyl]thiophene-2-carboxamide Traditional Name: N-[2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethylamino]-2-keto-ethyl]thiophene-2-carboxamide Formula: C19H24FN4O2S+ MolecularWeight: 391.482863

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCNC(=O)CNC(=O)C2=CC=CS2)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1CCNC(=O)CNC(=O)C2=CC=CS2)C3=CC=CC=C3F

InChI

InChI=1S/C19H23FN4O2S/c20-15-4-1-2-5-16(15)24-11-9-23(10-12-24)8-7-21-18(25)14-22-19(26)17-6-3-13-27-17/h1-6,13H,7-12,14H2,(H,21,25)(H,22,26)/p+1