3-(phenylmethyl)-2H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thione

Systemtic Name: 3-(phenylmethyl)-2H-[1,2,3]triazolo[4,5-d]pyrimidine-7-thione Openeye Name: 3-benzyl-2H-triazolo[4,5-d]pyrimidine-7-thione CAS Name: 3-(phenylmethyl)-2H-triazolo[4,5-d]pyrimidine-7-thione IUPAC Name: 3-benzyl-2H-triazolo[4,5-d]pyrimidine-7-thione Traditional Name: 3-benzyl-2H-triazolo[4,5-d]pyrimidine-7-thione Formula: C11H9N5S MolecularWeight: 243.28766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC=NC(=S)C3=NN2

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC=NC(=S)C3=NN2

InChI

InChI=1S/C11H9N5S/c17-11-9-10(12-7-13-11)16(15-14-9)6-8-4-2-1-3-5-8/h1-5,7,15H,6H2