2-[(4-methoxy-2-nitro-phenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(4-methoxy-2-nitro-phenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(4-methoxy-2-nitro-phenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[(4-methoxy-2-nitrophenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(4-methoxy-2-nitrophenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[(4-methoxy-2-nitro-phenoxy)methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C14H11N3O5S MolecularWeight: 333.31924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCC2=NC(=O)C3=C(N2)C=CS3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OCC2=NC(=O)C3=C(N2)C=CS3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N3O5S/c1-21-8-2-3-11(10(6-8)17(19)20)22-7-12-15-9-4-5-23-13(9)14(18)16-12/h2-6H,7H2,1H3,(H,15,16,18)