2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(2-nitrophenyl)acetamide CAS Name: 2-(4-benzofuro[3,2-d]pyrimidinylthio)-N-(2-nitrophenyl)acetamide IUPAC Name: 2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)-N-(2-nitrophenyl)acetamide Traditional Name: 2-(benzofuro[3,2-d]pyrimidin-4-ylthio)-N-(2-nitrophenyl)acetamide Formula: C18H12N4O4S MolecularWeight: 380.37728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C(=NC=N3)SCC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O4S/c23-15(21-12-6-2-3-7-13(12)22(24)25)9-27-18-17-16(19-10-20-18)11-5-1-4-8-14(11)26-17/h1-8,10H,9H2,(H,21,23)