7-dodecyl-3-methyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 7-dodecyl-3-methyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Openeye Name: 7-dodecyl-3-methyl-8-[(2Z)-2-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]purine-2,6-dione CAS Name: 7-dodecyl-3-methyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 7-dodecyl-3-methyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Traditional Name: 7-lauryl-3-methyl-8-[(N'Z)-N'-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]xanthine Formula: C28H40N6O2 MolecularWeight: 492.6562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C2=C(N=C1NN=C(C)C=CC3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCCCCN1C2=C(N=C1N/N=C(/C)\C=C\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C28H40N6O2/c1-4-5-6-7-8-9-10-11-12-16-21-34-24-25(33(3)28(36)30-26(24)35)29-27(34)32-31-22(2)19-20-23-17-14-13-15-18-23/h13-15,17-20H,4-12,16,21H2,1-3H3,(H,29,32)(H,30,35,36)/b20-19+,31-22-