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

Systemtic Name: 3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidine-7-thiolate Openeye Name: 3-benzyltriazolo[4,5-d]pyrimidine-7-thiolate CAS Name: 3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinethiolate IUPAC Name: 3-benzyltriazolo[4,5-d]pyrimidine-7-thiolate Traditional Name: 3-benzyltriazolo[4,5-d]pyrimidine-7-thiolate Formula: C11H8N5S- MolecularWeight: 242.27972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)[S-])N=N2

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)[S-])N=N2

InChI

InChI=1S/C11H9N5S/c17-11-9-10(12-7-13-11)16(15-14-9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13,17)/p-1