2-(phenylmethyl)-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(phenylmethyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-benzyl-1H-1,2,4-triazole-3-thione CAS Name: 2-(phenylmethyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-benzyl-1H-1,2,4-triazole-3-thione Traditional Name: 2-benzyl-1H-1,2,4-triazole-3-thione Formula: C9H9N3S MolecularWeight: 191.25286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=S)N=CN2

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=S)N=CN2

InChI

InChI=1S/C9H9N3S/c13-9-10-7-11-12(9)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,10,11,13)