9-(phenylmethyl)-2,3,4,5-tetrahydro-1H-purine-6-thione

Systemtic Name: 9-(phenylmethyl)-2,3,4,5-tetrahydro-1H-purine-6-thione Openeye Name: 9-benzyl-2,3,4,5-tetrahydro-1H-purine-6-thione CAS Name: 9-(phenylmethyl)-2,3,4,5-tetrahydro-1H-purine-6-thione IUPAC Name: 9-benzyl-2,3,4,5-tetrahydro-1H-purine-6-thione Traditional Name: 9-benzyl-2,3,4,5-tetrahydro-1H-purine-6-thione Formula: C12H14N4S MolecularWeight: 246.33136

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Descriptors Computed from Structure

Canonical SMILES:

C1NC2C(C(=S)N1)N=CN2CC3=CC=CC=C3

Isomeric SMILES

C1NC2C(C(=S)N1)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C12H14N4S/c17-12-10-11(13-7-14-12)16(8-15-10)6-9-4-2-1-3-5-9/h1-5,8,10-11,13H,6-7H2,(H,14,17)