S-(4-methyl-1,2,4-triazol-3-yl) benzenecarbothioate

Systemtic Name: S-(4-methyl-1,2,4-triazol-3-yl) benzenecarbothioate Openeye Name: S-(4-methyl-1,2,4-triazol-3-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(4-methyl-1,2,4-triazol-3-yl) ester IUPAC Name: S-(4-methyl-1,2,4-triazol-3-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(4-methyl-1,2,4-triazol-3-yl) ester Formula: C10H9N3OS MolecularWeight: 219.26296

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC(=O)C2=CC=CC=C2

Isomeric SMILES

CN1C=NN=C1SC(=O)C2=CC=CC=C2

InChI

InChI=1S/C10H9N3OS/c1-13-7-11-12-10(13)15-9(14)8-5-3-2-4-6-8/h2-7H,1H3