3-methyl-7-(3-methylbutyl)-8-(2-prop-1-en-2-ylhydrazinyl)purine-2,6-dione

Systemtic Name: 3-methyl-7-(3-methylbutyl)-8-(2-prop-1-en-2-ylhydrazinyl)purine-2,6-dione Openeye Name: 7-isopentyl-8-(2-isopropenylhydrazino)-3-methyl-purine-2,6-dione CAS Name: 3-methyl-7-(3-methylbutyl)-8-(1-methylethenylhydrazo)purine-2,6-dione IUPAC Name: 3-methyl-7-(3-methylbutyl)-8-(2-prop-1-en-2-ylhydrazinyl)purine-2,6-dione Traditional Name: 7-isoamyl-8-(N'-isopropenylhydrazino)-3-methyl-xanthine Formula: C14H22N6O2 MolecularWeight: 306.36348

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=C(N=C1NNC(=C)C)N(C(=O)NC2=O)C

Isomeric SMILES

CC(C)CCN1C2=C(N=C1NNC(=C)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C14H22N6O2/c1-8(2)6-7-20-10-11(15-13(20)18-17-9(3)4)19(5)14(22)16-12(10)21/h8,17H,3,6-7H2,1-2,4-5H3,(H,15,18)(H,16,21,22)