4-[(2-chloranyl-7H-purin-6-yl)amino]butanenitrile

Systemtic Name: 4-[(2-chloranyl-7H-purin-6-yl)amino]butanenitrile Openeye Name: 4-[(2-chloro-7H-purin-6-yl)amino]butanenitrile CAS Name: 4-[(2-chloro-7H-purin-6-yl)amino]butanenitrile IUPAC Name: 4-[(2-chloro-7H-purin-6-yl)amino]butanenitrile Traditional Name: 4-[(2-chloro-7H-purin-6-yl)amino]butyronitrile Formula: C9H9ClN6 MolecularWeight: 236.66096

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC(=N2)Cl)NCCCC#N

Isomeric SMILES

C1=NC2=C(N1)C(=NC(=N2)Cl)NCCCC#N

InChI

InChI=1S/C9H9ClN6/c10-9-15-7(12-4-2-1-3-11)6-8(16-9)14-5-13-6/h5H,1-2,4H2,(H2,12,13,14,15,16)