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

Systemtic Name: ethyl 3-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[(2-chloro-4-fluoro-phenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-chloro-4-fluorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-(2-chloro-4-fluoro-benzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C17H14ClFN2O3S MolecularWeight: 380.821063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=C(C=C3)F)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)N=CN(C2=O)CC3=C(C=C(C=C3)F)Cl)C

InChI

InChI=1S/C17H14ClFN2O3S/c1-3-24-17(23)14-9(2)13-15(25-14)20-8-21(16(13)22)7-10-4-5-11(19)6-12(10)18/h4-6,8H,3,7H2,1-2H3