[2-(2,2-diethoxyethylcarbamothioylamino)pyridin-3-yl] ethanoate

Systemtic Name: [2-(2,2-diethoxyethylcarbamothioylamino)pyridin-3-yl] ethanoate Openeye Name: [2-(2,2-diethoxyethylcarbamothioylamino)-3-pyridyl] acetate CAS Name: acetic acid [2-[[(2,2-diethoxyethylamino)-sulfanylidenemethyl]amino]-3-pyridinyl] ester IUPAC Name: [2-(2,2-diethoxyethylcarbamothioylamino)pyridin-3-yl] acetate Traditional Name: acetic acid [2-(2,2-diethoxyethylthiocarbamoylamino)-3-pyridyl] ester Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=S)NC1=C(C=CC=N1)OC(=O)C)OCC

Isomeric SMILES

CCOC(CNC(=S)NC1=C(C=CC=N1)OC(=O)C)OCC

InChI

InChI=1S/C14H21N3O4S/c1-4-19-12(20-5-2)9-16-14(22)17-13-11(21-10(3)18)7-6-8-15-13/h6-8,12H,4-5,9H2,1-3H3,(H2,15,16,17,22)