7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)purine-2,6-dione

Systemtic Name: 7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)purine-2,6-dione Openeye Name: 7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)purine-2,6-dione CAS Name: 7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)purine-2,6-dione IUPAC Name: 7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)purine-2,6-dione Traditional Name: 7-[(E)-but-2-enyl]-3-methyl-8-(methylamino)xanthine Formula: C11H15N5O2 MolecularWeight: 249.2691

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C2=C(N=C1NC)N(C(=O)NC2=O)C

Isomeric SMILES

C/C=C/CN1C2=C(N=C1NC)N(C(=O)NC2=O)C

InChI

InChI=1S/C11H15N5O2/c1-4-5-6-16-7-8(13-10(16)12-2)15(3)11(18)14-9(7)17/h4-5H,6H2,1-3H3,(H,12,13)(H,14,17,18)/b5-4+