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Reference substances

Reference substances

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General information

Inventory

EC number:
257-581-0
EC name:
(S)-(4,5-dihydro-5-thioxo-1,3,4-thiadiazol-2-yl) benzenecarbothioate
CAS number:
51988-14-8

No inventory information available

Reference substance information

IUPAC name:
phenyl[(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]methanone
Synonyms
Names:
S-(5-sulfanyl-1,3,4-thiadiazol-2-yl) benzenecarbothioate

CAS information

CAS number:
51988-14-8

Molecular and structural information

Molecular formula:
C9H6N2OS3
Molecular weight:
254.352
SMILES notation:
Sc1nnc(SC(=O)c2ccccc2)s1
InChl:
InChI=1/C9H6N2OS3/c12-7(6-4-2-1-3-5-6)14-9-11-10-8(13)15-9/h1-5H,(H,10,13)
Structural formula:
Chemical structure