7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]purine-2,6-dione

Systemtic Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]purine-2,6-dione Openeye Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(4-pyridylmethylene)hydrazino]purine-2,6-dione CAS Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]purine-2,6-dione IUPAC Name: 7-(2-hydroxyethyl)-3-methyl-8-[(2E)-2-(pyridin-4-ylmethylidene)hydrazinyl]purine-2,6-dione Traditional Name: 7-(2-hydroxyethyl)-3-methyl-8-[(N'E)-N'-(4-pyridylmethylene)hydrazino]xanthine Formula: C14H15N7O3 MolecularWeight: 329.314

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC3=CC=NC=C3)CCO

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)N/N=C/C3=CC=NC=C3)CCO

InChI

InChI=1S/C14H15N7O3/c1-20-11-10(12(23)18-14(20)24)21(6-7-22)13(17-11)19-16-8-9-2-4-15-5-3-9/h2-5,8,22H,6-7H2,1H3,(H,17,19)(H,18,23,24)/b16-8+