ethyl (1Z)-N-(6-chloranyl-8-ethyl-purin-9-yl)propanimidate

Systemtic Name: ethyl (1Z)-N-(6-chloranyl-8-ethyl-purin-9-yl)propanimidate Openeye Name: ethyl (1Z)-N-(6-chloro-8-ethyl-purin-9-yl)propanimidate CAS Name: (1Z)-N-(6-chloro-8-ethyl-9-purinyl)propanimidic acid ethyl ester IUPAC Name: ethyl (1Z)-N-(6-chloro-8-ethylpurin-9-yl)propanimidate Traditional Name: (1Z)-N-(6-chloro-8-ethyl-purin-9-yl)propionimidic acid ethyl ester Formula: C12H16ClN5O MolecularWeight: 281.74134

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1N=C(CC)OCC)N=CN=C2Cl

Isomeric SMILES

CCC1=NC2=C(N1/N=C(/CC)\OCC)N=CN=C2Cl

InChI

InChI=1S/C12H16ClN5O/c1-4-8-16-10-11(13)14-7-15-12(10)18(8)17-9(5-2)19-6-3/h7H,4-6H2,1-3H3/b17-9-