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

Systemtic Name: 1-(5-cyanopyridin-2-yl)-3-(2,2-diethoxyethyl)thiourea Openeye Name: 1-(5-cyano-2-pyridyl)-3-(2,2-diethoxyethyl)thiourea CAS Name: 1-(5-cyano-2-pyridinyl)-3-(2,2-diethoxyethyl)thiourea IUPAC Name: 1-(5-cyanopyridin-2-yl)-3-(2,2-diethoxyethyl)thiourea Traditional Name: 1-(5-cyano-2-pyridyl)-3-(2,2-diethoxyethyl)thiourea Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=S)NC1=NC=C(C=C1)C#N)OCC

Isomeric SMILES

CCOC(CNC(=S)NC1=NC=C(C=C1)C#N)OCC

InChI

InChI=1S/C13H18N4O2S/c1-3-18-12(19-4-2)9-16-13(20)17-11-6-5-10(7-14)8-15-11/h5-6,8,12H,3-4,9H2,1-2H3,(H2,15,16,17,20)