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

Systemtic Name: 4-[5-(furan-2-yl)-4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[5-(2-furyl)-4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile CAS Name: 4-[[5-(2-furanyl)-4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl]thio]butanenitrile IUPAC Name: 4-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[5-(2-furyl)-4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl]thio]butyronitrile Formula: C20H15N3O2S2 MolecularWeight: 393.482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCCC#N)SC=C3C4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCCC#N)SC=C3C4=CC=CO4

InChI

InChI=1S/C20H15N3O2S2/c21-10-4-5-12-26-20-22-18-17(15(13-27-18)16-9-6-11-25-16)19(24)23(20)14-7-2-1-3-8-14/h1-3,6-9,11,13H,4-5,12H2