3-[1-methyl-2,6-bis(oxidanylidene)-3-propyl-purin-7-yl]propanamide

Systemtic Name: 3-[1-methyl-2,6-bis(oxidanylidene)-3-propyl-purin-7-yl]propanamide Openeye Name: 3-(1-methyl-2,6-dioxo-3-propyl-purin-7-yl)propanamide CAS Name: 3-(1-methyl-2,6-dioxo-3-propyl-7-purinyl)propanamide IUPAC Name: 3-(1-methyl-2,6-dioxo-3-propylpurin-7-yl)propanamide Traditional Name: 3-(2,6-diketo-1-methyl-3-propyl-purin-7-yl)propionamide Formula: C12H17N5O3 MolecularWeight: 279.29508

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N

InChI

InChI=1S/C12H17N5O3/c1-3-5-17-10-9(11(19)15(2)12(17)20)16(7-14-10)6-4-8(13)18/h7H,3-6H2,1-2H3,(H2,13,18)