N-[5-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]carbonylthiophen-2-yl]cyclopropanecarboxamide

Systemtic Name: N-[5-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]carbonylthiophen-2-yl]cyclopropanecarboxamide Openeye Name: N-[5-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]-2-thienyl]cyclopropanecarboxamide CAS Name: N-[5-[[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-2-thiophenyl]cyclopropanecarboxamide IUPAC Name: N-[5-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-carbonyl]thiophen-2-yl]cyclopropanecarboxamide Traditional Name: N-[5-[4-(4-chlorobenzyl)piperazin-4-ium-1-carbonyl]-2-thienyl]cyclopropanecarboxamide Formula: C20H23ClN3O2S+ MolecularWeight: 404.93352

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=C(S2)C(=O)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC1C(=O)NC2=CC=C(S2)C(=O)N3CC[NH+](CC3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H22ClN3O2S/c21-16-5-1-14(2-6-16)13-23-9-11-24(12-10-23)20(26)17-7-8-18(27-17)22-19(25)15-3-4-15/h1-2,5-8,15H,3-4,9-13H2,(H,22,25)/p+1