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

Systemtic Name: cyclohexyl 3-[4-(4-chloranylphenoxy)butyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: cyclohexyl 3-[4-(4-chlorophenoxy)butyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[4-(4-chlorophenoxy)butyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-[4-(4-chlorophenoxy)butyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[4-(4-chlorophenoxy)butyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester Formula: C24H27ClN2O4S MolecularWeight: 475.00018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CCCCOC3=CC=C(C=C3)Cl)C(=O)OC4CCCCC4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CCCCOC3=CC=C(C=C3)Cl)C(=O)OC4CCCCC4

InChI

InChI=1S/C24H27ClN2O4S/c1-16-20-22(32-21(16)24(29)31-19-7-3-2-4-8-19)26-15-27(23(20)28)13-5-6-14-30-18-11-9-17(25)10-12-18/h9-12,15,19H,2-8,13-14H2,1H3