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

Systemtic Name: 2-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanenitrile Openeye Name: 2-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile CAS Name: 2-[[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylacetonitrile Traditional Name: 2-[[3-ethyl-5-(4-fluorophenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetonitrile Formula: C17H14FN3OS2 MolecularWeight: 359.440963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCC#N)SC(=C2C3=CC=C(C=C3)F)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCC#N)SC(=C2C3=CC=C(C=C3)F)C

InChI

InChI=1S/C17H14FN3OS2/c1-3-21-16(22)14-13(11-4-6-12(18)7-5-11)10(2)24-15(14)20-17(21)23-9-8-19/h4-7H,3,9H2,1-2H3