N-(4-bromanyl-2-methyl-phenyl)-2-(2-pyrimidin-2-ylsulfanylethanoylamino)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(2-pyrimidin-2-ylsulfanylethanoylamino)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[(2-pyrimidin-2-ylsulfanylacetyl)amino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[2-(2-pyrimidylthio)acetyl]amino]acetamide Formula: C15H15BrN4O2S MolecularWeight: 395.2742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC=CC=N2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C15H15BrN4O2S/c1-10-7-11(16)3-4-12(10)20-13(21)8-19-14(22)9-23-15-17-5-2-6-18-15/h2-7H,8-9H2,1H3,(H,19,22)(H,20,21)