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

Systemtic Name: 7-[(E)-but-2-enyl]-3-methyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione Openeye Name: 7-[(E)-but-2-enyl]-8-(2-isopropylidenehydrazino)-3-methyl-purine-2,6-dione CAS Name: 7-[(E)-but-2-enyl]-3-methyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione IUPAC Name: 7-[(E)-but-2-enyl]-3-methyl-8-(2-propan-2-ylidenehydrazinyl)purine-2,6-dione Traditional Name: 7-[(E)-but-2-enyl]-8-(N'-isopropylidenehydrazino)-3-methyl-xanthine Formula: C13H18N6O2 MolecularWeight: 290.32102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=CCN1C2=C(N=C1NN=C(C)C)N(C(=O)NC2=O)C

Isomeric SMILES

C/C=C/CN1C2=C(N=C1NN=C(C)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C13H18N6O2/c1-5-6-7-19-9-10(14-12(19)17-16-8(2)3)18(4)13(21)15-11(9)20/h5-6H,7H2,1-4H3,(H,14,17)(H,15,20,21)/b6-5+