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

Systemtic Name: 3-(7-oxidanylidene-2-phenoxy-6-thiophen-2-yl-pteridin-8-yl)propanenitrile Openeye Name: 3-[7-oxo-2-phenoxy-6-(2-thienyl)pteridin-8-yl]propanenitrile CAS Name: 3-(7-oxo-2-phenoxy-6-thiophen-2-yl-8-pteridinyl)propanenitrile IUPAC Name: 3-(7-oxo-2-phenoxy-6-thiophen-2-ylpteridin-8-yl)propanenitrile Traditional Name: 3-[7-keto-2-phenoxy-6-(2-thienyl)pteridin-8-yl]propionitrile Formula: C19H13N5O2S MolecularWeight: 375.40382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)CCC#N

Isomeric SMILES

C1=CC=C(C=C1)OC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)CCC#N

InChI

InChI=1S/C19H13N5O2S/c20-9-5-10-24-17-14(22-16(18(24)25)15-8-4-11-27-15)12-21-19(23-17)26-13-6-2-1-3-7-13/h1-4,6-8,11-12H,5,10H2