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

Systemtic Name: 3-methyl-7-nonyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Openeye Name: 3-methyl-8-[(2Z)-2-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]-7-nonyl-purine-2,6-dione CAS Name: 3-methyl-7-nonyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 3-methyl-7-nonyl-8-[(2Z)-2-[(E)-4-phenylbut-3-en-2-ylidene]hydrazinyl]purine-2,6-dione Traditional Name: 3-methyl-8-[(N'Z)-N'-[(E)-1-methyl-3-phenyl-prop-2-enylidene]hydrazino]-7-nonyl-xanthine Formula: C25H34N6O2 MolecularWeight: 450.57646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCN1C2=C(N=C1NN=C(C)C=CC3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCCN1C2=C(N=C1N/N=C(/C)\C=C\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C25H34N6O2/c1-4-5-6-7-8-9-13-18-31-21-22(30(3)25(33)27-23(21)32)26-24(31)29-28-19(2)16-17-20-14-11-10-12-15-20/h10-12,14-17H,4-9,13,18H2,1-3H3,(H,26,29)(H,27,32,33)/b17-16+,28-19-