7-butyl-3-methyl-8-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione

Systemtic Name: 7-butyl-3-methyl-8-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione Openeye Name: 7-butyl-3-methyl-8-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazino]purine-2,6-dione CAS Name: 7-butyl-3-methyl-8-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione IUPAC Name: 7-butyl-3-methyl-8-[(2Z)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]purine-2,6-dione Traditional Name: 7-butyl-3-methyl-8-[(N'Z)-N'-[(E)-3-phenylprop-2-enylidene]hydrazino]xanthine Formula: C19H22N6O2 MolecularWeight: 366.41698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(N=C1NN=CC=CC3=CC=CC=C3)N(C(=O)NC2=O)C

Isomeric SMILES

CCCCN1C2=C(N=C1N/N=C\C=C\C3=CC=CC=C3)N(C(=O)NC2=O)C

InChI

InChI=1S/C19H22N6O2/c1-3-4-13-25-15-16(24(2)19(27)22-17(15)26)21-18(25)23-20-12-8-11-14-9-6-5-7-10-14/h5-12H,3-4,13H2,1-2H3,(H,21,23)(H,22,26,27)/b11-8+,20-12-