6-chloranyl-9-prop-2-ynyl-purin-2-amine

Systemtic Name: 6-chloranyl-9-prop-2-ynyl-purin-2-amine Openeye Name: 6-chloro-9-prop-2-ynyl-purin-2-amine CAS Name: 6-chloro-9-prop-2-ynyl-2-purinamine IUPAC Name: 6-chloro-9-prop-2-ynylpurin-2-amine Traditional Name: (6-chloro-9-propargyl-purin-2-yl)amine Formula: C8H6ClN5 MolecularWeight: 207.61974

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C=NC2=C1N=C(N=C2Cl)N

Isomeric SMILES

C#CCN1C=NC2=C1N=C(N=C2Cl)N

InChI

InChI=1S/C8H6ClN5/c1-2-3-14-4-11-5-6(9)12-8(10)13-7(5)14/h1,4H,3H2,(H2,10,12,13)