2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-(5-cyclopropyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(5-cyclopropyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[(5-cyclopropyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-(5-cyclopropyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[(5-cyclopropyl-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C23H17FN4O4S2 MolecularWeight: 496.533883

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-])C5=CC=CC=C5

Isomeric SMILES

C1CC1C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC(=C(C=C4)F)[N+](=O)[O-])C5=CC=CC=C5

InChI

InChI=1S/C23H17FN4O4S2/c24-17-9-8-14(10-18(17)28(31)32)25-19(29)12-34-23-26-21-20(16(11-33-21)13-6-7-13)22(30)27(23)15-4-2-1-3-5-15/h1-5,8-11,13H,6-7,12H2,(H,25,29)