N-[2-azanyl-4,6-bis(chloranyl)phenyl]-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-[2-azanyl-4,6-bis(chloranyl)phenyl]-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(2-amino-4,6-dichloro-phenyl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(2-amino-4,6-dichlorophenyl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(2-amino-4,6-dichlorophenyl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(2-amino-4,6-dichloro-phenyl)-2-(2-pyrimidylthio)propionamide Formula: C13H12Cl2N4OS MolecularWeight: 343.23158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1N)Cl)Cl)SC2=NC=CC=N2

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1N)Cl)Cl)SC2=NC=CC=N2

InChI

InChI=1S/C13H12Cl2N4OS/c1-7(21-13-17-3-2-4-18-13)12(20)19-11-9(15)5-8(14)6-10(11)16/h2-7H,16H2,1H3,(H,19,20)