2-[4-(2-thiophen-2-ylethyl)piperazin-4-ium-1-yl]aniline

Systemtic Name: 2-[4-(2-thiophen-2-ylethyl)piperazin-4-ium-1-yl]aniline Openeye Name: 2-[4-[2-(2-thienyl)ethyl]piperazin-4-ium-1-yl]aniline CAS Name: 2-[4-(2-thiophen-2-ylethyl)-1-piperazin-4-iumyl]aniline IUPAC Name: 2-[4-(2-thiophen-2-ylethyl)piperazin-4-ium-1-yl]aniline Traditional Name: [2-[4-[2-(2-thienyl)ethyl]piperazin-4-ium-1-yl]phenyl]amine Formula: C16H22N3S+ MolecularWeight: 288.43098

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=CS2)C3=CC=CC=C3N

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=CS2)C3=CC=CC=C3N

InChI

InChI=1S/C16H21N3S/c17-15-5-1-2-6-16(15)19-11-9-18(10-12-19)8-7-14-4-3-13-20-14/h1-6,13H,7-12,17H2/p+1