N-(2-bromanyl-4-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-ethanamide Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-acetamide CAS Name: N-(2-bromo-4-nitrophenyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)oxy]acetamide IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxyacetamide Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)oxy-acetamide Formula: C16H13BrN4O4S MolecularWeight: 437.26782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC=NC(=C12)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=C(SC2=NC=NC(=C12)OCC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Br)C

InChI

InChI=1S/C16H13BrN4O4S/c1-8-9(2)26-16-14(8)15(18-7-19-16)25-6-13(22)20-12-4-3-10(21(23)24)5-11(12)17/h3-5,7H,6H2,1-2H3,(H,20,22)