cyclohexyl 5-methyl-4-oxidanylidene-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: cyclohexyl 5-methyl-4-oxidanylidene-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-4-oxo-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-propyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=C(S2)C(=O)OC3CCCCC3)C)C(=O)N1

Isomeric SMILES

CCCC1=NC2=C(C(=C(S2)C(=O)OC3CCCCC3)C)C(=O)N1

InChI

InChI=1S/C17H22N2O3S/c1-3-7-12-18-15(20)13-10(2)14(23-16(13)19-12)17(21)22-11-8-5-4-6-9-11/h11H,3-9H2,1-2H3,(H,18,19,20)