2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-prop-2-enyl-propanamide

Systemtic Name: 2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)propanamide CAS Name: 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N-prop-2-enylpropanamide IUPAC Name: 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)propionamide Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)N1C=NC2=C1C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C(=O)NCC=C)N1C=NC2=C1C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C13H17N5O3/c1-5-6-14-11(19)8(2)18-7-15-10-9(18)12(20)17(4)13(21)16(10)3/h5,7-8H,1,6H2,2-4H3,(H,14,19)