1-[2-(7H-purin-6-ylsulfanyl)ethyl]urea

Systemtic Name: 1-[2-(7H-purin-6-ylsulfanyl)ethyl]urea Openeye Name: 2-(7H-purin-6-ylsulfanyl)ethylurea CAS Name: 2-(7H-purin-6-ylthio)ethylurea IUPAC Name: 2-(7H-purin-6-ylsulfanyl)ethylurea Traditional Name: 2-(7H-purin-6-ylthio)ethylurea Formula: C8H10N6OS MolecularWeight: 238.2696

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1)C(=NC=N2)SCCNC(=O)N

Isomeric SMILES

C1=NC2=C(N1)C(=NC=N2)SCCNC(=O)N

InChI

InChI=1S/C8H10N6OS/c9-8(15)10-1-2-16-7-5-6(12-3-11-5)13-4-14-7/h3-4H,1-2H2,(H3,9,10,15)(H,11,12,13,14)