5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazole-3-thiolate Openeye Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazole-3-thiolate CAS Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-4-ethyl-1,2,4-triazole-3-thiolate IUPAC Name: 5-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-ethyl-1,2,4-triazole-3-thiolate Traditional Name: 5-[(1,3-benzothiazol-2-ylthio)methyl]-4-ethyl-1,2,4-triazole-3-thiolate Formula: C12H11N4S3- MolecularWeight: 307.43754

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1[S-])CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCN1C(=NN=C1[S-])CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C12H12N4S3/c1-2-16-10(14-15-11(16)17)7-18-12-13-8-5-3-4-6-9(8)19-12/h3-6H,2,7H2,1H3,(H,15,17)/p-1