3-(4-ethylphenyl)-6-piperidin-1-ium-4-ylsulfanyl-pyridazine

Systemtic Name: 3-(4-ethylphenyl)-6-piperidin-1-ium-4-ylsulfanyl-pyridazine Openeye Name: 3-(4-ethylphenyl)-6-piperidin-1-ium-4-ylsulfanyl-pyridazine CAS Name: 3-(4-ethylphenyl)-6-(4-piperidin-1-iumylthio)pyridazine IUPAC Name: 3-(4-ethylphenyl)-6-piperidin-1-ium-4-ylsulfanylpyridazine Traditional Name: 3-(4-ethylphenyl)-6-(piperidin-1-ium-4-ylthio)pyridazine Formula: C17H22N3S+ MolecularWeight: 300.44168

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NN=C(C=C2)SC3CC[NH2+]CC3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NN=C(C=C2)SC3CC[NH2+]CC3

InChI

InChI=1S/C17H21N3S/c1-2-13-3-5-14(6-4-13)16-7-8-17(20-19-16)21-15-9-11-18-12-10-15/h3-8,15,18H,2,9-12H2,1H3/p+1