1-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propan-2-one

Systemtic Name: 1-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propan-2-one Openeye Name: 1-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propan-2-one CAS Name: 1-(4-benzofuro[3,2-d]pyrimidinylthio)-2-propanone IUPAC Name: 1-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)propan-2-one Traditional Name: 1-(benzofuro[3,2-d]pyrimidin-4-ylthio)acetone Formula: C13H10N2O2S MolecularWeight: 258.2957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

Isomeric SMILES

CC(=O)CSC1=NC=NC2=C1OC3=CC=CC=C32

InChI

InChI=1S/C13H10N2O2S/c1-8(16)6-18-13-12-11(14-7-15-13)9-4-2-3-5-10(9)17-12/h2-5,7H,6H2,1H3