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

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C16H14N4O5S/c1-25-13-3-2-10(20(23)24)8-12(13)18-14(21)4-6-19-9-17-15-11(16(19)22)5-7-26-15/h2-3,5,7-9H,4,6H2,1H3,(H,18,21)