3-(6-phenylazanylpurin-9-yl)propanenitrile

Systemtic Name: 3-(6-phenylazanylpurin-9-yl)propanenitrile Openeye Name: 3-(6-anilinopurin-9-yl)propanenitrile CAS Name: 3-(6-anilino-9-purinyl)propanenitrile IUPAC Name: 3-(6-anilinopurin-9-yl)propanenitrile Traditional Name: 3-(6-anilinopurin-9-yl)propionitrile Formula: C14H12N6 MolecularWeight: 264.28528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC=NC3=C2N=CN3CCC#N

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC=NC3=C2N=CN3CCC#N

InChI

InChI=1S/C14H12N6/c15-7-4-8-20-10-18-12-13(16-9-17-14(12)20)19-11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,8H2,(H,16,17,19)