2-[7-(furan-2-ylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanylethanenitrile

Systemtic Name: 2-[7-(furan-2-ylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanylethanenitrile Openeye Name: 2-[7-(2-furylmethyl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanylacetonitrile CAS Name: 2-[[7-(2-furanylmethyl)-5,6-dimethyl-4-pyrrolo[2,3-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[7-(furan-2-ylmethyl)-5,6-dimethylpyrrolo[2,3-d]pyrimidin-4-yl]sulfanylacetonitrile Traditional Name: 2-[[7-(2-furfuryl)-5,6-dimethyl-pyrrolo[2,3-d]pyrimidin-4-yl]thio]acetonitrile Formula: C15H14N4OS MolecularWeight: 298.36286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C(=NC=N2)SCC#N)CC3=CC=CO3)C

Isomeric SMILES

CC1=C(N(C2=C1C(=NC=N2)SCC#N)CC3=CC=CO3)C

InChI

InChI=1S/C15H14N4OS/c1-10-11(2)19(8-12-4-3-6-20-12)14-13(10)15(18-9-17-14)21-7-5-16/h3-4,6,9H,7-8H2,1-2H3