(2R)-N-(2-cyanoethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: (2R)-N-(2-cyanoethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: (2R)-N-(2-cyanoethyl)-N-phenyl-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: (2R)-N-(2-cyanoethyl)-N-phenyl-2-(2-pyrimidinylthio)propanamide IUPAC Name: (2R)-N-(2-cyanoethyl)-N-phenyl-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: (2R)-N-(2-cyanoethyl)-N-phenyl-2-(2-pyrimidylthio)propionamide Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC=CC=N2

Isomeric SMILES

C[C@H](C(=O)N(CCC#N)C1=CC=CC=C1)SC2=NC=CC=N2

InChI

InChI=1S/C16H16N4OS/c1-13(22-16-18-10-6-11-19-16)15(21)20(12-5-9-17)14-7-3-2-4-8-14/h2-4,6-8,10-11,13H,5,12H2,1H3/t13-/m1/s1