1-pyridin-4-ylethyl carbamimidothioate

Systemtic Name: 1-pyridin-4-ylethyl carbamimidothioate Openeye Name: 2-[1-(4-pyridyl)ethyl]isothiourea CAS Name: carbamimidothioic acid 1-pyridin-4-ylethyl ester IUPAC Name: 1-pyridin-4-ylethyl carbamimidothioate Traditional Name: 2-[1-(4-pyridyl)ethyl]isothiourea Formula: C8H11N3S MolecularWeight: 181.25804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=NC=C1)SC(=N)N

Isomeric SMILES

CC(C1=CC=NC=C1)SC(=N)N

InChI

InChI=1S/C8H11N3S/c1-6(12-8(9)10)7-2-4-11-5-3-7/h2-6H,1H3,(H3,9,10)