4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-ium

Systemtic Name: 4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-ium Openeye Name: 4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-ium CAS Name: 4-[(1-methyl-2-imidazolyl)thio]piperidin-1-ium IUPAC Name: 4-(1-methylimidazol-2-yl)sulfanylpiperidin-1-ium Traditional Name: 4-[(1-methylimidazol-2-yl)thio]piperidin-1-ium Formula: C9H16N3S+ MolecularWeight: 198.30844

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2CC[NH2+]CC2

Isomeric SMILES

CN1C=CN=C1SC2CC[NH2+]CC2

InChI

InChI=1S/C9H15N3S/c1-12-7-6-11-9(12)13-8-2-4-10-5-3-8/h6-8,10H,2-5H2,1H3/p+1