1-[2-[9-(phenylmethyl)purin-6-yl]sulfanylethyl]urea

Systemtic Name: 1-[2-[9-(phenylmethyl)purin-6-yl]sulfanylethyl]urea Openeye Name: 2-(9-benzylpurin-6-yl)sulfanylethylurea CAS Name: 2-[[9-(phenylmethyl)-6-purinyl]thio]ethylurea IUPAC Name: 2-(9-benzylpurin-6-yl)sulfanylethylurea Traditional Name: 2-[(9-benzylpurin-6-yl)thio]ethylurea Formula: C15H16N6OS MolecularWeight: 328.39214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SCCNC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SCCNC(=O)N

InChI

InChI=1S/C15H16N6OS/c16-15(22)17-6-7-23-14-12-13(18-9-19-14)21(10-20-12)8-11-4-2-1-3-5-11/h1-5,9-10H,6-8H2,(H3,16,17,22)