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

Systemtic Name: 8-[(2E)-2-butan-2-ylidenehydrazinyl]-7-[(E)-but-2-enyl]-3-methyl-purine-2,6-dione Openeye Name: 7-[(E)-but-2-enyl]-3-methyl-8-[(2E)-2-(1-methylpropylidene)hydrazino]purine-2,6-dione CAS Name: 8-[(2E)-2-butan-2-ylidenehydrazinyl]-7-[(E)-but-2-enyl]-3-methylpurine-2,6-dione IUPAC Name: 8-[(2E)-2-butan-2-ylidenehydrazinyl]-7-[(E)-but-2-enyl]-3-methylpurine-2,6-dione Traditional Name: 7-[(E)-but-2-enyl]-3-methyl-8-[(N'E)-N'-(1-methylpropylidene)hydrazino]xanthine Formula: C14H20N6O2 MolecularWeight: 304.3476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC1=NC2=C(N1CC=CC)C(=O)NC(=O)N2C)C

Isomeric SMILES

CC/C(=N/NC1=NC2=C(N1C/C=C/C)C(=O)NC(=O)N2C)/C

InChI

InChI=1S/C14H20N6O2/c1-5-7-8-20-10-11(19(4)14(22)16-12(10)21)15-13(20)18-17-9(3)6-2/h5,7H,6,8H2,1-4H3,(H,15,18)(H,16,21,22)/b7-5+,17-9+