2-[2-(2-azanylethyl)-1,3-thiazol-4-yl]-N-(3-methylsulfanylpropyl)-1,3-thiazol-3-ium-4-carboxamide

Systemtic Name: 2-[2-(2-azanylethyl)-1,3-thiazol-4-yl]-N-(3-methylsulfanylpropyl)-1,3-thiazol-3-ium-4-carboxamide Openeye Name: 2-[2-(2-aminoethyl)thiazol-4-yl]-N-(3-methylsulfanylpropyl)thiazol-3-ium-4-carboxamide CAS Name: 2-[2-(2-aminoethyl)-4-thiazolyl]-N-[3-(methylthio)propyl]-4-thiazol-3-iumcarboxamide IUPAC Name: 2-[2-(2-aminoethyl)-1,3-thiazol-4-yl]-N-(3-methylsulfanylpropyl)-1,3-thiazol-3-ium-4-carboxamide Traditional Name: 2-[2-(2-aminoethyl)thiazol-4-yl]-N-[3-(methylthio)propyl]thiazol-3-ium-4-carboxamide Formula: C13H19N4OS3+ MolecularWeight: 343.51116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=O)C1=CSC(=[NH+]1)C2=CSC(=N2)CCN

Isomeric SMILES

CSCCCNC(=O)C1=CSC(=[NH+]1)C2=CSC(=N2)CCN

InChI

InChI=1S/C13H18N4OS3/c1-19-6-2-5-15-12(18)9-7-21-13(17-9)10-8-20-11(16-10)3-4-14/h7-8H,2-6,14H2,1H3,(H,15,18)/p+1