3-methyl-7-octyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 3-methyl-7-octyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 3-methyl-7-octyl-8-[(2Z)-2-(1-phenylethylidene)hydrazino]purine-2,6-dione CAS Name: 3-methyl-7-octyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione IUPAC Name: 3-methyl-7-octyl-8-[(2Z)-2-(1-phenylethylidene)hydrazinyl]purine-2,6-dione Traditional Name: 3-methyl-7-octyl-8-[(N'Z)-N'-(1-phenylethylidene)hydrazino]xanthine Formula: C22H30N6O2 MolecularWeight: 410.5126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(N=C1NN=C(C)C3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCCCCCN1C2=C(N=C1N/N=C(/C)\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C22H30N6O2/c1-4-5-6-7-8-12-15-28-18-19(27(3)22(30)24-20(18)29)23-21(28)26-25-16(2)17-13-10-9-11-14-17/h9-11,13-14H,4-8,12,15H2,1-3H3,(H,23,26)(H,24,29,30)/b25-16-