1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl N,N-diethylcarbamodithioate

Systemtic Name: 1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl N,N-diethylcarbamodithioate Openeye Name: 1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid 1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl ester IUPAC Name: 1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid 1H-imidazo[1,2-a]pyridin-4-ium-2-ylmethyl ester Formula: C13H18N3S2+ MolecularWeight: 280.43212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=C[N+]2=CC=CC=C2N1

Isomeric SMILES

CCN(CC)C(=S)SCC1=C[N+]2=CC=CC=C2N1

InChI

InChI=1S/C13H17N3S2/c1-3-15(4-2)13(17)18-10-11-9-16-8-6-5-7-12(16)14-11/h5-9H,3-4,10H2,1-2H3/p+1