N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-2-ethyl-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-2-ethyl-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(5-bromo-2-fluoro-benzyl)-2-ethyl-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C18H17BrFN3OS MolecularWeight: 422.314483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCC3=C(C=CC(=C3)Br)F)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCC3=C(C=CC(=C3)Br)F)C)C

InChI

InChI=1S/C18H17BrFN3OS/c1-4-14-22-10(3)15-9(2)16(25-18(15)23-14)17(24)21-8-11-7-12(19)5-6-13(11)20/h5-7H,4,8H2,1-3H3,(H,21,24)