3-[6-(1-methylindol-3-yl)-7-oxidanylidene-2-phenoxy-pteridin-8-yl]propanenitrile

Systemtic Name: 3-[6-(1-methylindol-3-yl)-7-oxidanylidene-2-phenoxy-pteridin-8-yl]propanenitrile Openeye Name: 3-[6-(1-methylindol-3-yl)-7-oxo-2-phenoxy-pteridin-8-yl]propanenitrile CAS Name: 3-[6-(1-methyl-3-indolyl)-7-oxo-2-phenoxy-8-pteridinyl]propanenitrile IUPAC Name: 3-[6-(1-methylindol-3-yl)-7-oxo-2-phenoxypteridin-8-yl]propanenitrile Traditional Name: 3-[7-keto-6-(1-methylindol-3-yl)-2-phenoxy-pteridin-8-yl]propionitrile Formula: C24H18N6O2 MolecularWeight: 422.43872

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C3=NC4=CN=C(N=C4N(C3=O)CCC#N)OC5=CC=CC=C5

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)C3=NC4=CN=C(N=C4N(C3=O)CCC#N)OC5=CC=CC=C5

InChI

InChI=1S/C24H18N6O2/c1-29-15-18(17-10-5-6-11-20(17)29)21-23(31)30(13-7-12-25)22-19(27-21)14-26-24(28-22)32-16-8-3-2-4-9-16/h2-6,8-11,14-15H,7,13H2,1H3