N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-2-(3-methyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-(5,6-dimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)-2-(3-methyl-4-nitro-phenoxy)ethanamide Openeye Name: N-(5,6-dimethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)-2-(3-methyl-4-nitro-phenoxy)acetamide CAS Name: N-(5,6-dimethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)-2-(3-methyl-4-nitrophenoxy)acetamide IUPAC Name: N-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-2-(3-methyl-4-nitrophenoxy)acetamide Traditional Name: N-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl)-2-(3-methyl-4-nitro-phenoxy)acetamide Formula: C17H16N4O5S MolecularWeight: 388.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)NN2C=NC3=C(C2=O)C(=C(S3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)NN2C=NC3=C(C2=O)C(=C(S3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O5S/c1-9-6-12(4-5-13(9)21(24)25)26-7-14(22)19-20-8-18-16-15(17(20)23)10(2)11(3)27-16/h4-6,8H,7H2,1-3H3,(H,19,22)