2-azanyl-4,4-diethoxy-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Systemtic Name: 2-azanyl-4,4-diethoxy-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-4,4-diethoxy-6-(4-pyridyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-4,4-diethoxy-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-4,4-diethoxy-6-pyridin-4-yl-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-4,4-diethoxy-6-(4-pyridyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C16H17N5O2 MolecularWeight: 311.33848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2(C(C2(C(=N1)N)C#N)C3=CC=NC=C3)C#N)OCC

Isomeric SMILES

CCOC1(C2(C(C2(C(=N1)N)C#N)C3=CC=NC=C3)C#N)OCC

InChI

InChI=1S/C16H17N5O2/c1-3-22-16(23-4-2)15(10-18)12(11-5-7-20-8-6-11)14(15,9-17)13(19)21-16/h5-8,12H,3-4H2,1-2H3,(H2,19,21)