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

Systemtic Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione Openeye Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(m-tolyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione CAS Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione IUPAC Name: 3-[(3-fluorophenyl)methyl]-1-methyl-6-[3-(3-methylphenyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-dione Traditional Name: 3-(3-fluorobenzyl)-1-methyl-6-[3-(m-tolyl)prop-1-ynyl]thieno[2,3-d]pyrimidine-2,4-quinone Formula: C24H19FN2O2S MolecularWeight: 418.483263

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC#CC2=CC3=C(S2)N(C(=O)N(C3=O)CC4=CC(=CC=C4)F)C

Isomeric SMILES

CC1=CC(=CC=C1)CC#CC2=CC3=C(S2)N(C(=O)N(C3=O)CC4=CC(=CC=C4)F)C

InChI

InChI=1S/C24H19FN2O2S/c1-16-6-3-7-17(12-16)8-5-11-20-14-21-22(28)27(24(29)26(2)23(21)30-20)15-18-9-4-10-19(25)13-18/h3-4,6-7,9-10,12-14H,8,15H2,1-2H3