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

Systemtic Name: 2-[(2R)-2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(2R)-2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[(2R)-2-[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]-1-pyrrolidin-1-iumyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(2R)-2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)pyrrolidin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(2R)-2-[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]pyrrolidin-1-ium-1-yl]-N-(2-thenyl)acetamide Formula: C16H24N5OS2+ MolecularWeight: 366.52466

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC)C2CCC[NH+]2CC(=O)NCC3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SC)[C@H]2CCC[NH+]2CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C16H23N5OS2/c1-3-21-15(18-19-16(21)23-2)13-7-4-8-20(13)11-14(22)17-10-12-6-5-9-24-12/h5-6,9,13H,3-4,7-8,10-11H2,1-2H3,(H,17,22)/p+1/t13-/m1/s1