2-[(5-azanyl-6-naphthalen-2-yloxy-pyrimidin-4-yl)-(cyanomethyl)amino]ethanenitrile

Systemtic Name: 2-[(5-azanyl-6-naphthalen-2-yloxy-pyrimidin-4-yl)-(cyanomethyl)amino]ethanenitrile Openeye Name: 2-[[5-amino-6-(2-naphthyloxy)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile CAS Name: 2-[[5-amino-6-(2-naphthalenyloxy)-4-pyrimidinyl]-(cyanomethyl)amino]acetonitrile IUPAC Name: 2-[(5-amino-6-naphthalen-2-yloxypyrimidin-4-yl)-(cyanomethyl)amino]acetonitrile Traditional Name: 2-[[5-amino-6-(2-naphthoxy)pyrimidin-4-yl]-(cyanomethyl)amino]acetonitrile Formula: C18H14N6O MolecularWeight: 330.34336

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N6O/c19-7-9-24(10-8-20)17-16(21)18(23-12-22-17)25-15-6-5-13-3-1-2-4-14(13)11-15/h1-6,11-12H,9-10,21H2