4-[(Z)-(2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-2-nitro-phenolate

Systemtic Name: 4-[(Z)-(2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-2-nitro-phenolate Openeye Name: 4-[(Z)-(2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-2-nitro-phenolate CAS Name: 4-[(Z)-(2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)iminomethyl]-2-nitrophenolate IUPAC Name: 4-[(Z)-(2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)iminomethyl]-2-nitrophenolate Traditional Name: 4-[(Z)-(4-keto-2-methyl-thieno[2,3-d]pyrimidin-3-yl)iminomethyl]-2-nitro-phenolate Formula: C14H9N4O4S- MolecularWeight: 329.31066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CS2)C(=O)N1N=CC3=CC(=C(C=C3)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(C=CS2)C(=O)N1/N=C\C3=CC(=C(C=C3)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O4S/c1-8-16-13-10(4-5-23-13)14(20)17(8)15-7-9-2-3-12(19)11(6-9)18(21)22/h2-7,19H,1H3/p-1/b15-7-