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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCCCC#N)SC=C2C3=CC=C(C=C3)F

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCCCC#N)SC=C2C3=CC=C(C=C3)F

InChI

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