3,7-dimethyl-8-(prop-2-enylamino)purine-2,6-dione

Systemtic Name: 3,7-dimethyl-8-(prop-2-enylamino)purine-2,6-dione Openeye Name: 8-(allylamino)-3,7-dimethyl-purine-2,6-dione CAS Name: 3,7-dimethyl-8-(prop-2-enylamino)purine-2,6-dione IUPAC Name: 3,7-dimethyl-8-(prop-2-enylamino)purine-2,6-dione Traditional Name: 8-(allylamino)-3,7-dimethyl-xanthine Formula: C10H13N5O2 MolecularWeight: 235.24252

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCC=C)N(C(=O)NC2=O)C

Isomeric SMILES

CN1C2=C(N=C1NCC=C)N(C(=O)NC2=O)C

InChI

InChI=1S/C10H13N5O2/c1-4-5-11-9-12-7-6(14(9)2)8(16)13-10(17)15(7)3/h4H,1,5H2,2-3H3,(H,11,12)(H,13,16,17)