ethyl 5-methyl-2-[(1S)-1-(4-methyl-2-nitro-phenoxy)ethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-2-[(1S)-1-(4-methyl-2-nitro-phenoxy)ethyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-2-[(1S)-1-(4-methyl-2-nitro-phenoxy)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[(1S)-1-(4-methyl-2-nitrophenoxy)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-2-[(1S)-1-(4-methyl-2-nitrophenoxy)ethyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(1S)-1-(4-methyl-2-nitro-phenoxy)ethyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H19N3O6S MolecularWeight: 417.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)C(C)OC3=C(C=C(C=C3)C)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=C(NC2=O)[C@H](C)OC3=C(C=C(C=C3)C)[N+](=O)[O-])C

InChI

InChI=1S/C19H19N3O6S/c1-5-27-19(24)15-10(3)14-17(23)20-16(21-18(14)29-15)11(4)28-13-7-6-9(2)8-12(13)22(25)26/h6-8,11H,5H2,1-4H3,(H,20,21,23)/t11-/m0/s1