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

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-N-phenyl-piperazin-4-ium-1-carboxamide Openeye Name: 4-[(5-chloro-2-thienyl)methyl]-N-phenyl-piperazin-4-ium-1-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-N-phenyl-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(5-chlorothiophen-2-yl)methyl]-N-phenylpiperazin-4-ium-1-carboxamide Traditional Name: 4-[(5-chloro-2-thienyl)methyl]-N-phenyl-piperazin-4-ium-1-carboxamide Formula: C16H19ClN3OS+ MolecularWeight: 336.85956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(S2)Cl)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C16H18ClN3OS/c17-15-7-6-14(22-15)12-19-8-10-20(11-9-19)16(21)18-13-4-2-1-3-5-13/h1-7H,8-12H2,(H,18,21)/p+1