methyl-[2-oxidanylidene-2-(propylamino)ethyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-(propylamino)ethyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Openeye Name: methyl-[2-oxo-2-(propylamino)ethyl]-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium CAS Name: methyl-[2-oxo-2-(propylamino)ethyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]ammonium IUPAC Name: methyl-[2-oxo-2-(propylamino)ethyl]-[(3-sulfanylidene-5-thiophen-2-yl-1H-1,2,4-triazol-2-yl)methyl]azanium Traditional Name: [2-keto-2-(propylamino)ethyl]-methyl-[[5-(2-thienyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl]ammonium Formula: C13H20N5OS2+ MolecularWeight: 326.4608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CN1C(=S)N=C(N1)C2=CC=CS2

Isomeric SMILES

CCCNC(=O)C[NH+](C)CN1C(=S)N=C(N1)C2=CC=CS2

InChI

InChI=1S/C13H19N5OS2/c1-3-6-14-11(19)8-17(2)9-18-13(20)15-12(16-18)10-5-4-7-21-10/h4-5,7H,3,6,8-9H2,1-2H3,(H,14,19)(H,15,16,20)/p+1