1-(5-bromanylpyridin-2-yl)-3-(2,2-diethoxyethyl)thiourea

Systemtic Name: 1-(5-bromanylpyridin-2-yl)-3-(2,2-diethoxyethyl)thiourea Openeye Name: 1-(5-bromo-2-pyridyl)-3-(2,2-diethoxyethyl)thiourea CAS Name: 1-(5-bromo-2-pyridinyl)-3-(2,2-diethoxyethyl)thiourea IUPAC Name: 1-(5-bromopyridin-2-yl)-3-(2,2-diethoxyethyl)thiourea Traditional Name: 1-(5-bromo-2-pyridyl)-3-(2,2-diethoxyethyl)thiourea Formula: C12H18BrN3O2S MolecularWeight: 348.25922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=S)NC1=NC=C(C=C1)Br)OCC

Isomeric SMILES

CCOC(CNC(=S)NC1=NC=C(C=C1)Br)OCC

InChI

InChI=1S/C12H18BrN3O2S/c1-3-17-11(18-4-2)8-15-12(19)16-10-6-5-9(13)7-14-10/h5-7,11H,3-4,8H2,1-2H3,(H2,14,15,16,19)