2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]acetyl]amino]thiophene-3-carboxamide Formula: C17H20FN4O2S+ MolecularWeight: 363.429703

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=C(C=CS2)C(=O)N)C3=CC=CC=C3F

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=C(C=CS2)C(=O)N)C3=CC=CC=C3F

InChI

InChI=1S/C17H19FN4O2S/c18-13-3-1-2-4-14(13)22-8-6-21(7-9-22)11-15(23)20-17-12(16(19)24)5-10-25-17/h1-5,10H,6-9,11H2,(H2,19,24)(H,20,23)/p+1