2,2-dimethyl-N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]propanamide

Systemtic Name: 2,2-dimethyl-N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]propanamide Openeye Name: 2,2-dimethyl-N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]propanamide CAS Name: 2,2-dimethyl-N-[4-[1-oxo-2-(2-pyrimidinylthio)propyl]phenyl]propanamide IUPAC Name: 2,2-dimethyl-N-[4-(2-pyrimidin-2-ylsulfanylpropanoyl)phenyl]propanamide Traditional Name: 2,2-dimethyl-N-[4-[2-(2-pyrimidylthio)propanoyl]phenyl]propionamide Formula: C18H21N3O2S MolecularWeight: 343.44324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)NC(=O)C(C)(C)C)SC2=NC=CC=N2

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)NC(=O)C(C)(C)C)SC2=NC=CC=N2

InChI

InChI=1S/C18H21N3O2S/c1-12(24-17-19-10-5-11-20-17)15(22)13-6-8-14(9-7-13)21-16(23)18(2,3)4/h5-12H,1-4H3,(H,21,23)