Vitas-M small molecule compound
9-chloro-2-thioxo-1,2,3,4-tetrahydro-5H-6,1,3-benzoxadiazocin-5-one
Catalog ID
STK783239
SMILES O=C1CNC(=S)Nc2c(O1)ccc(c2)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C9H7ClN2O2S MW 242.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7ClN2O2S/c10-5-1-2-7-6(3-5)12-9(15)11-4-8(13)14-7/h1-3H,4H2,(H2,11,12,15)InChIKey
ORYBLDYNOFWKOW-UHFFFAOYSA-NSynonyms
9CHLORO2SULFANYLIDENE34DIHYDRO1H613BENZOXADIAZOCIN5ONE
9chloro2thioxo1234tetrahydro5H613benzoxadiazocin5one
C1C(=O)OC2=C(C=C(C=C2)Cl)NC(=S)N1
InChI=1SC9H7ClN2O2Sc1051276(35)129(15)1148(13)147h13H4H2(H2111215)
MFCD06617855
ZINC000004745333
ZINC04745333
ZINC4745333
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