3-[(5-azanyl-6-naphthalen-2-yloxy-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile

Systemtic Name: 3-[(5-azanyl-6-naphthalen-2-yloxy-pyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile Openeye Name: 3-[[5-amino-6-(2-naphthyloxy)pyrimidin-4-yl]-(2-cyanoethyl)amino]propanenitrile CAS Name: 3-[[5-amino-6-(2-naphthalenyloxy)-4-pyrimidinyl]-(2-cyanoethyl)amino]propanenitrile IUPAC Name: 3-[(5-amino-6-naphthalen-2-yloxypyrimidin-4-yl)-(2-cyanoethyl)amino]propanenitrile Traditional Name: 3-[[5-amino-6-(2-naphthoxy)pyrimidin-4-yl]-(2-cyanoethyl)amino]propionitrile Formula: C20H18N6O MolecularWeight: 358.39652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)OC3=NC=NC(=C3N)N(CCC#N)CCC#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)OC3=NC=NC(=C3N)N(CCC#N)CCC#N

InChI

InChI=1S/C20H18N6O/c21-9-3-11-26(12-4-10-22)19-18(23)20(25-14-24-19)27-17-8-7-15-5-1-2-6-16(15)13-17/h1-2,5-8,13-14H,3-4,11-12,23H2