2-ethyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-ethyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-ethyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-ethyl-N-[3-[(4-fluorophenyl)thio]propyl]-4,5-dimethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-ethyl-N-[3-(4-fluorophenyl)sulfanylpropyl]-4,5-dimethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-ethyl-N-[3-[(4-fluorophenyl)thio]propyl]-4,5-dimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C20H22FN3OS2 MolecularWeight: 403.536583

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCCCSC3=CC=C(C=C3)F)C)C

Isomeric SMILES

CCC1=NC(=C2C(=C(SC2=N1)C(=O)NCCCSC3=CC=C(C=C3)F)C)C

InChI

InChI=1S/C20H22FN3OS2/c1-4-16-23-13(3)17-12(2)18(27-20(17)24-16)19(25)22-10-5-11-26-15-8-6-14(21)7-9-15/h6-9H,4-5,10-11H2,1-3H3,(H,22,25)