N-(6-chloranyl-9-propan-2-yl-purin-2-yl)-3-methyl-butanamide

Systemtic Name: N-(6-chloranyl-9-propan-2-yl-purin-2-yl)-3-methyl-butanamide Openeye Name: N-(6-chloro-9-isopropyl-purin-2-yl)-3-methyl-butanamide CAS Name: N-(6-chloro-9-propan-2-yl-2-purinyl)-3-methylbutanamide IUPAC Name: N-(6-chloro-9-propan-2-ylpurin-2-yl)-3-methylbutanamide Traditional Name: N-(6-chloro-9-isopropyl-purin-2-yl)-3-methyl-butyramide Formula: C13H18ClN5O MolecularWeight: 295.76792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C(C)C

Isomeric SMILES

CC(C)CC(=O)NC1=NC2=C(C(=N1)Cl)N=CN2C(C)C

InChI

InChI=1S/C13H18ClN5O/c1-7(2)5-9(20)16-13-17-11(14)10-12(18-13)19(6-15-10)8(3)4/h6-8H,5H2,1-4H3,(H,16,17,18,20)