ethyl 5-methyl-3-[(E)-(4-nitrophenyl)methylideneamino]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-methyl-3-[(E)-(4-nitrophenyl)methylideneamino]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-3-[(E)-(4-nitrophenyl)methyleneamino]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[(E)-(4-nitrophenyl)methylideneamino]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[(E)-(4-nitrophenyl)methylideneamino]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[(E)-(4-nitrobenzylidene)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H14N4O5S MolecularWeight: 386.38186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N=CC3=CC=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)/N=C/C3=CC=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C17H14N4O5S/c1-3-26-17(23)14-10(2)13-15(27-14)18-9-20(16(13)22)19-8-11-4-6-12(7-5-11)21(24)25/h4-9H,3H2,1-2H3/b19-8+