2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one

Systemtic Name: 2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Openeye Name: 2-[(5-phenyloxazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one CAS Name: 2-[(5-phenyl-2-oxazolyl)methylthio]-6-propyl-1H-pyrimidin-4-one IUPAC Name: 2-[(5-phenyl-1,3-oxazol-2-yl)methylsulfanyl]-6-propyl-1H-pyrimidin-4-one Traditional Name: 2-[(5-phenyloxazol-2-yl)methylthio]-6-propyl-1H-pyrimidin-4-one Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SCC2=NC=C(O2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)SCC2=NC=C(O2)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-2-6-13-9-15(21)20-17(19-13)23-11-16-18-10-14(22-16)12-7-4-3-5-8-12/h3-5,7-10H,2,6,11H2,1H3,(H,19,20,21)