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

Systemtic Name: 4-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxo-thieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxo-2-thieno[2,3-d]pyrimidinyl]thio]butanenitrile IUPAC Name: 4-[3-ethyl-5-(4-fluorophenyl)-6-methyl-4-oxothieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-ethyl-5-(4-fluorophenyl)-4-keto-6-methyl-thieno[2,3-d]pyrimidin-2-yl]thio]butyronitrile Formula: C19H18FN3OS2 MolecularWeight: 387.494123

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(N=C1SCCCC#N)SC(=C2C3=CC=C(C=C3)F)C

Isomeric SMILES

CCN1C(=O)C2=C(N=C1SCCCC#N)SC(=C2C3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H18FN3OS2/c1-3-23-18(24)16-15(13-6-8-14(20)9-7-13)12(2)26-17(16)22-19(23)25-11-5-4-10-21/h6-9H,3-5,11H2,1-2H3