5-thiophen-2-yl-1,2-dihydro-1,2,4-triazole-3-thione hydrate

Systemtic Name: 5-thiophen-2-yl-1,2-dihydro-1,2,4-triazole-3-thione hydrate Openeye Name: 5-(2-thienyl)-1,2-dihydro-1,2,4-triazole-3-thione hydrate CAS Name: 5-thiophen-2-yl-1,2-dihydro-1,2,4-triazole-3-thione hydrate IUPAC Name: 5-thiophen-2-yl-1,2-dihydro-1,2,4-triazole-3-thione hydrate Traditional Name: 5-(2-thienyl)-1,2-dihydro-1,2,4-triazole-3-thione hydrate Formula: C6H7N3OS2 MolecularWeight: 201.26928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NC(=S)NN2.O

Isomeric SMILES

C1=CSC(=C1)C2=NC(=S)NN2.O

InChI

InChI=1S/C6H5N3S2.H2O/c10-6-7-5(8-9-6)4-2-1-3-11-4;/h1-3H,(H2,7,8,9,10);1H2