ethyl 2-[2-[3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[2-[3-(3-cyano-6-phenyl-pyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]ethanoate Openeye Name: ethyl 2-[2-[3-[(3-cyano-6-phenyl-2-pyridyl)sulfanyl]propanoylamino]thiazol-4-yl]acetate CAS Name: 2-[2-[[3-[(3-cyano-6-phenyl-2-pyridinyl)thio]-1-oxopropyl]amino]-4-thiazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[3-(3-cyano-6-phenylpyridin-2-yl)sulfanylpropanoylamino]-1,3-thiazol-4-yl]acetate Traditional Name: 2-[2-[3-[(3-cyano-6-phenyl-2-pyridyl)thio]propanoylamino]thiazol-4-yl]acetic acid ethyl ester Formula: C22H20N4O3S2 MolecularWeight: 452.5492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CSC(=N1)NC(=O)CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)CC1=CSC(=N1)NC(=O)CCSC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H20N4O3S2/c1-2-29-20(28)12-17-14-31-22(24-17)26-19(27)10-11-30-21-16(13-23)8-9-18(25-21)15-6-4-3-5-7-15/h3-9,14H,2,10-12H2,1H3,(H,24,26,27)