N-phenyl-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-phenyl-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-phenyl-4-(2-thienylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-phenyl-4-(thiophen-2-ylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-phenyl-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-phenyl-4-(2-thenyl)piperazin-4-ium-1-carboxamide Formula: C16H20N3OS+ MolecularWeight: 302.4145

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CS2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C16H19N3OS/c20-16(17-14-5-2-1-3-6-14)19-10-8-18(9-11-19)13-15-7-4-12-21-15/h1-7,12H,8-11,13H2,(H,17,20)/p+1