4-([1]benzofuro[3,2-d]pyrimidin-4-yloxy)-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-([1]benzofuro[3,2-d]pyrimidin-4-yloxy)-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-(benzofuro[3,2-d]pyrimidin-4-yloxy)-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-(4-benzofuro[3,2-d]pyrimidinyloxy)-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-([1]benzofuro[3,2-d]pyrimidin-4-yloxy)-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-(benzofuro[3,2-d]pyrimidin-4-yloxy)-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C20H18N4O6S MolecularWeight: 442.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=NC=NC3=C2OC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=NC=NC3=C2OC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O6S/c1-3-23(4-2)31(27,28)13-9-10-17(15(11-13)24(25)26)30-20-19-18(21-12-22-20)14-7-5-6-8-16(14)29-19/h5-12H,3-4H2,1-2H3