6-chloranyl-2-pentylsulfanyl-5-phenyl-1H-pyrimidin-4-one

Systemtic Name: 6-chloranyl-2-pentylsulfanyl-5-phenyl-1H-pyrimidin-4-one Openeye Name: 6-chloro-2-pentylsulfanyl-5-phenyl-1H-pyrimidin-4-one CAS Name: 6-chloro-2-(pentylthio)-5-phenyl-1H-pyrimidin-4-one IUPAC Name: 6-chloro-2-pentylsulfanyl-5-phenyl-1H-pyrimidin-4-one Traditional Name: 2-(amylthio)-6-chloro-5-phenyl-1H-pyrimidin-4-one Formula: C15H17ClN2OS MolecularWeight: 308.82628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC(=O)C(=C(N1)Cl)C2=CC=CC=C2

Isomeric SMILES

CCCCCSC1=NC(=O)C(=C(N1)Cl)C2=CC=CC=C2

InChI

InChI=1S/C15H17ClN2OS/c1-2-3-7-10-20-15-17-13(16)12(14(19)18-15)11-8-5-4-6-9-11/h4-6,8-9H,2-3,7,10H2,1H3,(H,17,18,19)