2-[4-(5-cyano-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)phenoxy]-N,N-diethyl-ethanamide

Systemtic Name: 2-[4-(5-cyano-4-oxidanylidene-2-sulfanylidene-1H-pyrimidin-6-yl)phenoxy]-N,N-diethyl-ethanamide Openeye Name: 2-[4-(5-cyano-4-oxo-2-thioxo-1H-pyrimidin-6-yl)phenoxy]-N,N-diethyl-acetamide CAS Name: 2-[4-(5-cyano-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)phenoxy]-N,N-diethylacetamide IUPAC Name: 2-[4-(5-cyano-4-oxo-2-sulfanylidene-1H-pyrimidin-6-yl)phenoxy]-N,N-diethylacetamide Traditional Name: 2-[4-(5-cyano-4-keto-2-thioxo-1H-pyrimidin-6-yl)phenoxy]-N,N-diethyl-acetamide Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1=CC=C(C=C1)C2=C(C(=O)NC(=S)N2)C#N

Isomeric SMILES

CCN(CC)C(=O)COC1=CC=C(C=C1)C2=C(C(=O)NC(=S)N2)C#N

InChI

InChI=1S/C17H18N4O3S/c1-3-21(4-2)14(22)10-24-12-7-5-11(6-8-12)15-13(9-18)16(23)20-17(25)19-15/h5-8H,3-4,10H2,1-2H3,(H2,19,20,23,25)