3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylsulfanylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione

Systemtic Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylsulfanylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylsulfanylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-[3-(methylthio)phenyl]prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylsulfanylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 3-(3-fluorobenzyl)-1-methyl-6-[3-[3-(methylthio)phenyl]prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-quinone Formula: C24H19FN2O2S2 MolecularWeight: 450.548263

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(S2)C#CCC3=CC(=CC=C3)SC)C(=O)N(C1=O)CC4=CC(=CC=C4)F

Isomeric SMILES

CN1C2=C(C=C(S2)C#CCC3=CC(=CC=C3)SC)C(=O)N(C1=O)CC4=CC(=CC=C4)F

InChI

InChI=1S/C24H19FN2O2S2/c1-26-23-21(22(28)27(24(26)29)15-17-8-3-9-18(25)12-17)14-20(31-23)11-5-7-16-6-4-10-19(13-16)30-2/h3-4,6,8-10,12-14H,7,15H2,1-2H3