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

Systemtic Name: ethyl 5-methyl-3-(3-methylbutyl)-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-isopentyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-(3-methylbutyl)-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-3-(3-methylbutyl)-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-isoamyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C15H20N2O3S MolecularWeight: 308.3959

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CCC(C)C)C

InChI

InChI=1S/C15H20N2O3S/c1-5-20-15(19)12-10(4)11-13(21-12)16-8-17(14(11)18)7-6-9(2)3/h8-9H,5-7H2,1-4H3