3-butyl-1,3-thiazol-3-ium; 3-propyl-1,3-thiazol-3-ium

Systemtic Name: 3-butyl-1,3-thiazol-3-ium; 3-propyl-1,3-thiazol-3-ium Openeye Name: 3-butylthiazol-3-ium; 3-propylthiazol-3-ium CAS Name: 3-butylthiazol-3-ium; 3-propylthiazol-3-ium IUPAC Name: 3-butyl-1,3-thiazol-3-ium; 3-propyl-1,3-thiazol-3-ium Traditional Name: 3-butylthiazol-3-ium; 3-propylthiazol-3-ium Formula: C13H22N2S2+2 MolecularWeight: 270.45718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CSC=C1.CCC[N+]1=CSC=C1

Isomeric SMILES

CCCC[N+]1=CSC=C1.CCC[N+]1=CSC=C1

InChI

InChI=1S/C7H12NS.C6H10NS/c1-2-3-4-8-5-6-9-7-8;1-2-3-7-4-5-8-6-7/h5-7H,2-4H2,1H3;4-6H,2-3H2,1H3/q2*+1