N-[4-(phenylmethyl)piperazin-4-ium-1-yl]-1-thiophen-2-yl-ethanimine

Systemtic Name: N-[4-(phenylmethyl)piperazin-4-ium-1-yl]-1-thiophen-2-yl-ethanimine Openeye Name: N-(4-benzylpiperazin-4-ium-1-yl)-1-(2-thienyl)ethanimine CAS Name: N-[4-(phenylmethyl)-1-piperazin-4-iumyl]-1-thiophen-2-ylethanimine IUPAC Name: N-(4-benzylpiperazin-4-ium-1-yl)-1-thiophen-2-ylethanimine Traditional Name: (Z)-(4-benzylpiperazin-4-ium-1-yl)-[1-(2-thienyl)ethylidene]amine Formula: C17H22N3S+ MolecularWeight: 300.44168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN1CC[NH+](CC1)CC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

C/C(=N/N1CC[NH+](CC1)CC2=CC=CC=C2)/C3=CC=CS3

InChI

InChI=1S/C17H21N3S/c1-15(17-8-5-13-21-17)18-20-11-9-19(10-12-20)14-16-6-3-2-4-7-16/h2-8,13H,9-12,14H2,1H3/p+1/b18-15-