N-[9-propanoyl-2-(propanoylamino)purin-6-yl]propanamide

Systemtic Name: N-[9-propanoyl-2-(propanoylamino)purin-6-yl]propanamide Openeye Name: N-[9-propanoyl-2-(propanoylamino)purin-6-yl]propanamide CAS Name: N-[9-(1-oxopropyl)-2-(1-oxopropylamino)-6-purinyl]propanamide IUPAC Name: N-[9-propanoyl-2-(propanoylamino)purin-6-yl]propanamide Traditional Name: N-(2-propionamido-9-propionyl-purin-6-yl)propionamide Formula: C14H18N6O3 MolecularWeight: 318.33112

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=NC(=NC2=C1N=CN2C(=O)CC)NC(=O)CC

Isomeric SMILES

CCC(=O)NC1=NC(=NC2=C1N=CN2C(=O)CC)NC(=O)CC

InChI

InChI=1S/C14H18N6O3/c1-4-8(21)16-12-11-13(20(7-15-11)10(23)6-3)19-14(18-12)17-9(22)5-2/h7H,4-6H2,1-3H3,(H2,16,17,18,19,21,22)