(4-diazanylphthalazin-1-yl)diazane; 1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: (4-diazanylphthalazin-1-yl)diazane; 1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 1,3-dimethyl-7H-purine-2,6-dione; (4-hydrazinophthalazin-1-yl)hydrazine CAS Name: 1,3-dimethyl-7H-purine-2,6-dione; (4-hydrazinyl-1-phthalazinyl)hydrazine IUPAC Name: 1,3-dimethyl-7H-purine-2,6-dione; (4-hydrazinylphthalazin-1-yl)hydrazine Traditional Name: (4-hydrazinophthalazin-1-yl)hydrazine; theophylline Formula: C15H18N10O2 MolecularWeight: 370.36922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC=N2.C1=CC=C2C(=C1)C(=NN=C2NN)NN

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC=N2.C1=CC=C2C(=C1)C(=NN=C2NN)NN

InChI

InChI=1S/C8H10N6.C7H8N4O2/c9-11-7-5-3-1-2-4-6(5)8(12-10)14-13-7;1-10-5-4(8-3-9-5)6(12)11(2)7(10)13/h1-4H,9-10H2,(H,11,13)(H,12,14);3H,1-2H3,(H,8,9)