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

Systemtic Name: cyclohexyl 5-methyl-3-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 3-[2-(isobutylamino)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-3-[2-(2-methylpropylamino)-2-oxoethyl]-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 5-methyl-3-[2-(2-methylpropylamino)-2-oxoethyl]-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(isobutylamino)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O4S/c1-12(2)9-21-15(24)10-23-11-22-18-16(19(23)25)13(3)17(28-18)20(26)27-14-7-5-4-6-8-14/h11-12,14H,4-10H2,1-3H3,(H,21,24)