N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanyl-ethanamide Openeye Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-[(3-cyano-2-pyridyl)sulfanyl]acetamide CAS Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-2-pyrrolyl]-2-[(3-cyano-2-pyridinyl)thio]acetamide IUPAC Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]pyrrol-2-yl]-2-(3-cyanopyridin-2-yl)sulfanylacetamide Traditional Name: N-[3-cyano-4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrrol-2-yl]-2-[(3-cyano-2-pyridyl)thio]acetamide Formula: C20H21N5O2S MolecularWeight: 395.47804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=C(C=CC=N2)C#N)CC3CCCO3)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=C(C=CC=N2)C#N)C[C@H]3CCCO3)C

InChI

InChI=1S/C20H21N5O2S/c1-13-14(2)25(11-16-6-4-8-27-16)19(17(13)10-22)24-18(26)12-28-20-15(9-21)5-3-7-23-20/h3,5,7,16H,4,6,8,11-12H2,1-2H3,(H,24,26)/t16-/m1/s1