methyl 2-(6-nitro-2-oxidanylidene-4-phenyl-thieno[2,3-d]pyrimidin-1-yl)ethanoate

Systemtic Name: methyl 2-(6-nitro-2-oxidanylidene-4-phenyl-thieno[2,3-d]pyrimidin-1-yl)ethanoate Openeye Name: methyl 2-(6-nitro-2-oxo-4-phenyl-thieno[2,3-d]pyrimidin-1-yl)acetate CAS Name: 2-(6-nitro-2-oxo-4-phenyl-1-thieno[2,3-d]pyrimidinyl)acetic acid methyl ester IUPAC Name: methyl 2-(6-nitro-2-oxo-4-phenylthieno[2,3-d]pyrimidin-1-yl)acetate Traditional Name: 2-(2-keto-6-nitro-4-phenyl-thieno[2,3-d]pyrimidin-1-yl)acetic acid methyl ester Formula: C15H11N3O5S MolecularWeight: 345.32994

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=C(C=C(S2)[N+](=O)[O-])C(=NC1=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)CN1C2=C(C=C(S2)[N+](=O)[O-])C(=NC1=O)C3=CC=CC=C3

InChI

InChI=1S/C15H11N3O5S/c1-23-12(19)8-17-14-10(7-11(24-14)18(21)22)13(16-15(17)20)9-5-3-2-4-6-9/h2-7H,8H2,1H3