ethyl N-[1-methyl-4-(2-methylprop-2-enyl)-5-methylsulfanyl-1,2,4-triazol-4-ium-3-yl]carbamate

Systemtic Name: ethyl N-[1-methyl-4-(2-methylprop-2-enyl)-5-methylsulfanyl-1,2,4-triazol-4-ium-3-yl]carbamate Openeye Name: ethyl N-[1-methyl-4-(2-methylallyl)-5-methylsulfanyl-1,2,4-triazol-4-ium-3-yl]carbamate CAS Name: N-[1-methyl-4-(2-methylprop-2-enyl)-5-(methylthio)-1,2,4-triazol-4-ium-3-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-methyl-4-(2-methylprop-2-enyl)-5-methylsulfanyl-1,2,4-triazol-4-ium-3-yl]carbamate Traditional Name: N-[1-methyl-4-(2-methylallyl)-5-(methylthio)-1,2,4-triazol-4-ium-3-yl]carbamic acid ethyl ester Formula: C11H19N4O2S+ MolecularWeight: 271.35916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NN(C(=[N+]1CC(=C)C)SC)C

Isomeric SMILES

CCOC(=O)NC1=NN(C(=[N+]1CC(=C)C)SC)C

InChI

InChI=1S/C11H18N4O2S/c1-6-17-10(16)12-9-13-14(4)11(18-5)15(9)7-8(2)3/h2,6-7H2,1,3-5H3/p+1