S-(1,2,3,4-thiatriazol-5-yl) 4-methylbenzenecarbothioate

Systemtic Name: S-(1,2,3,4-thiatriazol-5-yl) 4-methylbenzenecarbothioate Openeye Name: S-(thiatriazol-5-yl) 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-(5-thiatriazolyl) ester IUPAC Name: S-(thiatriazol-5-yl) 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-(thiatriazol-5-yl) ester Formula: C9H7N3OS2 MolecularWeight: 237.30138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SC2=NN=NS2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SC2=NN=NS2

InChI

InChI=1S/C9H7N3OS2/c1-6-2-4-7(5-3-6)8(13)14-9-10-11-12-15-9/h2-5H,1H3