Vitas-M small molecule compound

methyl 6-chloro-2-thioxo-1,3-benzoxazole-3(2H)-carboxylate

Catalog ID
STK834726
SMILES COC(=O)n1c(=S)oc2c1ccc(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 C9H6ClNO3S MW 243.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H6ClNO3S/c1-13-8(12)11-6-3-2-5(10)4-7(6)14-9(11)15/h2-4H,1H3
InChIKey
IKWIGBHXGMUPCB-UHFFFAOYSA-N
Synonyms
49740-44-5
49740445
6CHLORO2SULFANYLIDENE13BENZOXAZOLE3CARBOXYLICACIDMETHYLESTER
6CHLORO2THIOXO13BENZOXAZOLE3CARBOXYLICACIDMETHYLESTER
COC(=O)N1C2=C(C=C(C=C2)Cl)OC1=S
InChI=1SC9H6ClNO3Sc1138(12)116325(10)47(6)149(11)15h24H1H3
METHYL6CHLORANYL2SULFANYLIDENE13BENZOXAZOLE3CARBOXYLATE
METHYL6CHLORO2SULFANYLIDENE13BENZOXAZOLE3CARBOXYLATE
methyl6chloro2thioxo13benzoxazole3(2H)carboxylate
methyl6chloro2thioxobenzo(d)oxazole3(2H)carboxylate
MFCD00453715
ZINC000000050022
ZINC00050022
ZINC50022

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.