2-[(2R)-2-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2R)-2-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(2R)-2-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[(2R)-2-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]-1-pyrrolidin-1-iumyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(2R)-2-(4-methyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-2-[4-methyl-5-(methylthio)-1,2,4-triazol-3-yl]pyrrolidin-1-ium-1-yl]-N-(2-thenyl)acetamide Formula: C15H22N5OS2+ MolecularWeight: 352.49808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC)C2CCC[NH+]2CC(=O)NCC3=CC=CS3

Isomeric SMILES

CN1C(=NN=C1SC)[C@H]2CCC[NH+]2CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C15H21N5OS2/c1-19-14(17-18-15(19)22-2)12-6-3-7-20(12)10-13(21)16-9-11-5-4-8-23-11/h4-5,8,12H,3,6-7,9-10H2,1-2H3,(H,16,21)/p+1/t12-/m1/s1