1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea

Systemtic Name: 1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea Openeye Name: 1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea CAS Name: 1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea IUPAC Name: 1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea Traditional Name: 1-methyl-3-[2-(7H-purin-6-ylamino)ethyl]urea Formula: C9H13N7O MolecularWeight: 235.24582

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NCCNC1=NC=NC2=C1NC=N2

Isomeric SMILES

CNC(=O)NCCNC1=NC=NC2=C1NC=N2

InChI

InChI=1S/C9H13N7O/c1-10-9(17)12-3-2-11-7-6-8(14-4-13-6)16-5-15-7/h4-5H,2-3H2,1H3,(H2,10,12,17)(H2,11,13,14,15,16)