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

Systemtic Name: ethyl 5-methyl-4-oxidanylidene-3-[(E)-pyridin-4-ylmethylideneamino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-methyl-4-oxo-3-[(E)-4-pyridylmethyleneamino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-[(E)-pyridin-4-ylmethylideneamino]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-oxo-3-[(E)-pyridin-4-ylmethylideneamino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-3-[(E)-4-pyridylmethyleneamino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)N=CC3=CC=NC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)/N=C/C3=CC=NC=C3)C

InChI

InChI=1S/C16H14N4O3S/c1-3-23-16(22)13-10(2)12-14(24-13)18-9-20(15(12)21)19-8-11-4-6-17-7-5-11/h4-9H,3H2,1-2H3/b19-8+