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

Systemtic Name: ethyl 5-methyl-3-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-3-[(E)-(5-nitro-2-thienyl)methyleneamino]-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[(E)-(5-nitro-2-thiophenyl)methylideneamino]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-[(E)-(5-nitrothiophen-2-yl)methylideneamino]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[(E)-(5-nitro-2-thienyl)methyleneamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H12N4O5S2 MolecularWeight: 392.40958

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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(S3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)/N=C/C3=CC=C(S3)[N+](=O)[O-])C

InChI

InChI=1S/C15H12N4O5S2/c1-3-24-15(21)12-8(2)11-13(26-12)16-7-18(14(11)20)17-6-9-4-5-10(25-9)19(22)23/h4-7H,3H2,1-2H3/b17-6+