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

Systemtic Name: 4-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)butan-2-one Openeye Name: 4-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)butan-2-one CAS Name: 4-(4-benzofuro[3,2-d]pyrimidinylthio)-2-butanone IUPAC Name: 4-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)butan-2-one Traditional Name: 4-(benzofuro[3,2-d]pyrimidin-4-ylthio)butan-2-one Formula: C14H12N2O2S MolecularWeight: 272.32228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCSC1=NC=NC2=C1OC3=CC=CC=C32

Isomeric SMILES

CC(=O)CCSC1=NC=NC2=C1OC3=CC=CC=C32

InChI

InChI=1S/C14H12N2O2S/c1-9(17)6-7-19-14-13-12(15-8-16-14)10-4-2-3-5-11(10)18-13/h2-5,8H,6-7H2,1H3