3-ethyl-5-methyl-N-(3-nitro-5-phenoxy-phenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-ethyl-5-methyl-N-(3-nitro-5-phenoxy-phenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-ethyl-5-methyl-N-(3-nitro-5-phenoxy-phenyl)-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-ethyl-5-methyl-N-(3-nitro-5-phenoxyphenyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-ethyl-5-methyl-N-(3-nitro-5-phenoxyphenyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-ethyl-4-keto-5-methyl-N-(3-nitro-5-phenoxy-phenyl)thieno[2,3-d]pyrimidine-6-carboxamide Formula: C22H18N4O5S MolecularWeight: 450.46712

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC(=CC(=C3)OC4=CC=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CCN1C=NC2=C(C1=O)C(=C(S2)C(=O)NC3=CC(=CC(=C3)OC4=CC=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H18N4O5S/c1-3-25-12-23-21-18(22(25)28)13(2)19(32-21)20(27)24-14-9-15(26(29)30)11-17(10-14)31-16-7-5-4-6-8-16/h4-12H,3H2,1-2H3,(H,24,27)