2-[5-(4-fluorophenyl)-6-methyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile

Systemtic Name: 2-[5-(4-fluorophenyl)-6-methyl-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[5-(4-fluorophenyl)-6-methyl-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[5-(4-fluorophenyl)-6-methyl-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[5-(4-fluorophenyl)-6-methyl-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[5-(4-fluorophenyl)-4-keto-6-methyl-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetonitrile Formula: C21H14FN3OS2 MolecularWeight: 407.483763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCC#N)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(N(C2=O)C3=CC=CC=C3)SCC#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H14FN3OS2/c1-13-17(14-7-9-15(22)10-8-14)18-19(28-13)24-21(27-12-11-23)25(20(18)26)16-5-3-2-4-6-16/h2-10H,12H2,1H3