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

Systemtic Name: cyclohexyl 5-methyl-4-oxidanylidene-3-prop-2-enyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 3-allyl-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-3-prop-2-enyl-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-allyl-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC=C)C(=O)OC3CCCCC3

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC=C)C(=O)OC3CCCCC3

InChI

InChI=1S/C17H20N2O3S/c1-3-9-19-10-18-15-13(16(19)20)11(2)14(23-15)17(21)22-12-7-5-4-6-8-12/h3,10,12H,1,4-9H2,2H3