tert-butyl N-(9-butyl-6-chloranyl-purin-2-yl)carbamate

Systemtic Name: tert-butyl N-(9-butyl-6-chloranyl-purin-2-yl)carbamate Openeye Name: tert-butyl N-(9-butyl-6-chloro-purin-2-yl)carbamate CAS Name: N-(9-butyl-6-chloro-2-purinyl)carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(9-butyl-6-chloropurin-2-yl)carbamate Traditional Name: N-(9-butyl-6-chloro-purin-2-yl)carbamic acid tert-butyl ester Formula: C14H20ClN5O2 MolecularWeight: 325.7939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C1N=C(N=C2Cl)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCN1C=NC2=C1N=C(N=C2Cl)NC(=O)OC(C)(C)C

InChI

InChI=1S/C14H20ClN5O2/c1-5-6-7-20-8-16-9-10(15)17-12(18-11(9)20)19-13(21)22-14(2,3)4/h8H,5-7H2,1-4H3,(H,17,18,19,21)