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

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-N-(2,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-[(5-chloro-2-thienyl)methyl]-N-(2,4-dichlorophenyl)piperazin-4-ium-1-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-N-(2,4-dichlorophenyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-[(5-chlorothiophen-2-yl)methyl]-N-(2,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-[(5-chloro-2-thienyl)methyl]-N-(2,4-dichlorophenyl)piperazin-4-ium-1-carboxamide Formula: C16H17Cl3N3OS+ MolecularWeight: 405.74968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Cl3N3OS/c17-11-1-3-14(13(18)9-11)20-16(23)22-7-5-21(6-8-22)10-12-2-4-15(19)24-12/h1-4,9H,5-8,10H2,(H,20,23)/p+1