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2-(7H-purin-2-yl)ethanenitrile

2-(7H-purin-2-yl)ethanenitrile

Systemtic Name:2-(7H-purin-2-yl)ethanenitrile
Openeye Name:2-(7H-purin-2-yl)acetonitrile
CAS Name:2-(7H-purin-2-yl)acetonitrile
IUPAC Name:2-(7H-purin-2-yl)acetonitrile
Traditional Name:2-(7H-purin-2-yl)acetonitrile
Formula: C7H5N5
MolecularWeight: 159.1481
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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=N1)CC#N)N=CN2


Isomeric SMILES

C1=C2C(=NC(=N1)CC#N)N=CN2


InChI

InChI=1S/C7H5N5/c8-2-1-6-9-3-5-7(12-6)11-4-10-5/h3-4H,1H2,(H,9,10,11,12)


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