azepan-1-yl-(4-chloranyl-2-methylsulfanyl-pyrimidin-5-yl)methanone

Systemtic Name: azepan-1-yl-(4-chloranyl-2-methylsulfanyl-pyrimidin-5-yl)methanone Openeye Name: azepan-1-yl-(4-chloro-2-methylsulfanyl-pyrimidin-5-yl)methanone CAS Name: 1-azepanyl-[4-chloro-2-(methylthio)-5-pyrimidinyl]methanone IUPAC Name: azepan-1-yl-(4-chloro-2-methylsulfanylpyrimidin-5-yl)methanone Traditional Name: azepan-1-yl-[4-chloro-2-(methylthio)pyrimidin-5-yl]methanone Formula: C12H16ClN3OS MolecularWeight: 285.79294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)Cl)C(=O)N2CCCCCC2

Isomeric SMILES

CSC1=NC=C(C(=N1)Cl)C(=O)N2CCCCCC2

InChI

InChI=1S/C12H16ClN3OS/c1-18-12-14-8-9(10(13)15-12)11(17)16-6-4-2-3-5-7-16/h8H,2-7H2,1H3