N-(4,5-dimethyl-2-nitro-phenyl)-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

CC1=CC(=C(C=C1C)[N+](=O)[O-])NC(=O)CN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C16H14N4O4S/c1-9-5-12(13(20(23)24)6-10(9)2)18-14(21)7-19-8-17-15-11(16(19)22)3-4-25-15/h3-6,8H,7H2,1-2H3,(H,18,21)