(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-[2-(3-pyridyl)thiazol-4-yl]acetate CAS Name: 2-[2-(3-pyridinyl)-4-thiazolyl]acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetate Traditional Name: 2-[2-(3-pyridyl)thiazol-4-yl]acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H14N4O3S MolecularWeight: 342.37236

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CC1=CSC(=N1)C2=CN=CC=C2

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CC1=CSC(=N1)C2=CN=CC=C2

InChI

InChI=1S/C16H14N4O3S/c1-10(18)13(6-17)14(21)8-23-15(22)5-12-9-24-16(20-12)11-3-2-4-19-7-11/h2-4,7,9,13,18H,5,8H2,1H3