4-[(5-chloranylthiophen-2-yl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[(5-chloro-2-thienyl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-N-propyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(5-chlorothiophen-2-yl)methyl]-N-propylpiperazin-4-ium-1-carboxamide Traditional Name: 4-[(5-chloro-2-thienyl)methyl]-N-propyl-piperazin-4-ium-1-carboxamide Formula: C13H21ClN3OS+ MolecularWeight: 302.84334

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CC[NH+](CC1)CC2=CC=C(S2)Cl

Isomeric SMILES

CCCNC(=O)N1CC[NH+](CC1)CC2=CC=C(S2)Cl

InChI

InChI=1S/C13H20ClN3OS/c1-2-5-15-13(18)17-8-6-16(7-9-17)10-11-3-4-12(14)19-11/h3-4H,2,5-10H2,1H3,(H,15,18)/p+1