1-(3-methylthiophen-2-yl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Systemtic Name: 1-(3-methylthiophen-2-yl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Openeye Name: 1-(3-methyl-2-thienyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine CAS Name: 1-(3-methyl-2-thiophenyl)-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanimine IUPAC Name: 1-(3-methylthiophen-2-yl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Traditional Name: (E)-(3-methyl-2-thienyl)methylene-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C15H19N4S+ MolecularWeight: 287.40316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C=NN2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CC1=C(SC=C1)/C=N/N2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C15H18N4S/c1-13-5-11-20-14(13)12-17-19-9-7-18(8-10-19)15-4-2-3-6-16-15/h2-6,11-12H,7-10H2,1H3/p+1/b17-12+