3-[(2R)-1-cyclohexylpyrrolidin-1-ium-2-yl]-4-methyl-5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,2,4-triazole

Systemtic Name: 3-[(2R)-1-cyclohexylpyrrolidin-1-ium-2-yl]-4-methyl-5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,2,4-triazole Openeye Name: 3-[(2R)-1-cyclohexylpyrrolidin-1-ium-2-yl]-4-methyl-5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,2,4-triazole CAS Name: 3-[(2R)-1-cyclohexyl-2-pyrrolidin-1-iumyl]-4-methyl-5-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1,2,4-triazole IUPAC Name: 3-[(2R)-1-cyclohexylpyrrolidin-1-ium-2-yl]-4-methyl-5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,2,4-triazole Traditional Name: 3-[(2R)-1-cyclohexylpyrrolidin-1-ium-2-yl]-4-methyl-5-(2-pyrrolidin-1-ium-1-ylethylthio)-1,2,4-triazole Formula: C19H35N5S+2 MolecularWeight: 365.5797

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC[NH+]2CCCC2)C3CCC[NH+]3C4CCCCC4

Isomeric SMILES

CN1C(=NN=C1SCC[NH+]2CCCC2)[C@H]3CCC[NH+]3C4CCCCC4

InChI

InChI=1S/C19H33N5S/c1-22-18(17-10-7-13-24(17)16-8-3-2-4-9-16)20-21-19(22)25-15-14-23-11-5-6-12-23/h16-17H,2-15H2,1H3/p+2/t17-/m1/s1