2-(2-azanyl-7H-purin-6-yl)-N,N-di(propan-2-yl)benzamide

Systemtic Name: 2-(2-azanyl-7H-purin-6-yl)-N,N-di(propan-2-yl)benzamide Openeye Name: 2-(2-amino-7H-purin-6-yl)-N,N-diisopropyl-benzamide CAS Name: 2-(2-amino-7H-purin-6-yl)-N,N-di(propan-2-yl)benzamide IUPAC Name: 2-(2-amino-7H-purin-6-yl)-N,N-di(propan-2-yl)benzamide Traditional Name: 2-(2-amino-7H-purin-6-yl)-N,N-diisopropyl-benzamide Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C1=CC=CC=C1C2=C3C(=NC(=N2)N)N=CN3

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C1=CC=CC=C1C2=C3C(=NC(=N2)N)N=CN3

InChI

InChI=1S/C18H22N6O/c1-10(2)24(11(3)4)17(25)13-8-6-5-7-12(13)14-15-16(21-9-20-15)23-18(19)22-14/h5-11H,1-4H3,(H3,19,20,21,22,23)