3-hexyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 3-hexyl-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 3-hexyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-hexyl-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylate IUPAC Name: 3-hexyl-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-hexyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Formula: C14H17N2O3S- MolecularWeight: 293.36138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

Isomeric SMILES

CCCCCCN1C=NC2=C(C1=O)C(=C(S2)C(=O)[O-])C

InChI

InChI=1S/C14H18N2O3S/c1-3-4-5-6-7-16-8-15-12-10(13(16)17)9(2)11(20-12)14(18)19/h8H,3-7H2,1-2H3,(H,18,19)/p-1