ethyl 2-(6-azanyl-3,5-dicyano-4-propan-2-yl-pyridin-2-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(6-azanyl-3,5-dicyano-4-propan-2-yl-pyridin-2-yl)sulfanylethanoate Openeye Name: ethyl 2-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)sulfanyl]acetate CAS Name: 2-[(6-amino-3,5-dicyano-4-propan-2-yl-2-pyridinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(6-amino-3,5-dicyano-4-propan-2-ylpyridin-2-yl)sulfanylacetate Traditional Name: 2-[(6-amino-3,5-dicyano-4-isopropyl-2-pyridyl)thio]acetic acid ethyl ester Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=C(C(=N1)N)C#N)C(C)C)C#N

Isomeric SMILES

CCOC(=O)CSC1=C(C(=C(C(=N1)N)C#N)C(C)C)C#N

InChI

InChI=1S/C14H16N4O2S/c1-4-20-11(19)7-21-14-10(6-16)12(8(2)3)9(5-15)13(17)18-14/h8H,4,7H2,1-3H3,(H2,17,18)