methyl 4-(5-fluoranyl-2-nitro-phenoxy)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 4-(5-fluoranyl-2-nitro-phenoxy)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-(5-fluoro-2-nitro-phenoxy)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(5-fluoro-2-nitrophenoxy)-2,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(5-fluoro-2-nitrophenoxy)-2,5-dimethylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(5-fluoro-2-nitro-phenoxy)-2,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C16H12FN3O5S MolecularWeight: 377.346983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)OC3=C(C=CC(=C3)F)[N+](=O)[O-])C)C(=O)OC

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)OC3=C(C=CC(=C3)F)[N+](=O)[O-])C)C(=O)OC

InChI

InChI=1S/C16H12FN3O5S/c1-7-12-14(25-11-6-9(17)4-5-10(11)20(22)23)18-8(2)19-15(12)26-13(7)16(21)24-3/h4-6H,1-3H3