1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea Openeye Name: 1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea CAS Name: 1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea IUPAC Name: 1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea Traditional Name: 1-(1,3-benzodioxol-5-yl)-3-(7H-purin-6-yl)urea Formula: C13H10N6O3 MolecularWeight: 298.2569

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=NC=NC4=C3NC=N4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)NC(=O)NC3=NC=NC4=C3NC=N4

InChI

InChI=1S/C13H10N6O3/c20-13(18-7-1-2-8-9(3-7)22-6-21-8)19-12-10-11(15-4-14-10)16-5-17-12/h1-5H,6H2,(H3,14,15,16,17,18,19,20)