3-[4-methyl-5-sulfanylidene-1-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-methyl-5-sulfanylidene-1-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-methyl-1-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-5-thioxo-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-methyl-5-sulfanylidene-1-[[(2R)-2-thiophen-2-yl-1-pyrrolidin-1-iumyl]methyl]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-methyl-5-sulfanylidene-1-[[(2R)-2-thiophen-2-ylpyrrolidin-1-ium-1-yl]methyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-methyl-1-[[(2R)-2-(2-thienyl)pyrrolidin-1-ium-1-yl]methyl]-5-thioxo-1,2,4-triazol-3-yl]propionamide Formula: C15H22N5OS2+ MolecularWeight: 352.49808

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCCC2C3=CC=CS3)CCC(=O)N

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCC[C@@H]2C3=CC=CS3)CCC(=O)N

InChI

InChI=1S/C15H21N5OS2/c1-18-14(7-6-13(16)21)17-20(15(18)22)10-19-8-2-4-11(19)12-5-3-9-23-12/h3,5,9,11H,2,4,6-8,10H2,1H3,(H2,16,21)/p+1/t11-/m1/s1