2-[(2-fluorophenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[(2-fluorophenyl)methylsulfanyl]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(2-fluorophenyl)methylthio]-5-(4-methylphenyl)-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2-fluorophenyl)methylsulfanyl]-5-(4-methylphenyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-[(2-fluorobenzyl)thio]-5-(p-tolyl)thieno[2,3-d]pyrimidin-4-one Formula: C23H19FN2OS2 MolecularWeight: 422.538163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4F)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC4=CC=CC=C4F)CC=C

InChI

InChI=1S/C23H19FN2OS2/c1-3-12-26-22(27)20-18(16-10-8-15(2)9-11-16)14-28-21(20)25-23(26)29-13-17-6-4-5-7-19(17)24/h3-11,14H,1,12-13H2,2H3