3-(2-methoxy-7-oxidanylidene-6-thiophen-2-yl-pteridin-8-yl)propanenitrile

Systemtic Name: 3-(2-methoxy-7-oxidanylidene-6-thiophen-2-yl-pteridin-8-yl)propanenitrile Openeye Name: 3-[2-methoxy-7-oxo-6-(2-thienyl)pteridin-8-yl]propanenitrile CAS Name: 3-(2-methoxy-7-oxo-6-thiophen-2-yl-8-pteridinyl)propanenitrile IUPAC Name: 3-(2-methoxy-7-oxo-6-thiophen-2-ylpteridin-8-yl)propanenitrile Traditional Name: 3-[7-keto-2-methoxy-6-(2-thienyl)pteridin-8-yl]propionitrile Formula: C14H11N5O2S MolecularWeight: 313.33444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CS3)CCC#N

Isomeric SMILES

COC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=CS3)CCC#N

InChI

InChI=1S/C14H11N5O2S/c1-21-14-16-8-9-12(18-14)19(6-3-5-15)13(20)11(17-9)10-4-2-7-22-10/h2,4,7-8H,3,6H2,1H3