Vitas-M small molecule compound
3-(2,1,3-benzothiadiazol-4-ylcarbamoyl)-2,2-dimethylcyclopropanecarboxylic acid
Catalog ID
STL160106
SMILES O=C(C1C(C1(C)C)C(=O)O)Nc1cccc2c1nsn2
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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 C13H13N3O3S MW 291.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N3O3S/c1-13(2)8(9(13)12(18)19)11(17)14-6-4-3-5-7-10(6)16-20-15-7/h3-5,8-9H,1-2H3,(H,14,17)(H,18,19)InChIKey
CWUVLDUVHWWRCE-UHFFFAOYSA-NSynonyms
1324056-96-31324056963
3(213benzothiadiazol4ylcarbamoyl)22dimethylcyclopropane1carboxylicacid
3(213benzothiadiazol4ylcarbamoyl)22dimethylcyclopropanecarboxylicacid
3(benzo(c)(125)thiadiazol4ylcarbamoyl)22dimethylcyclopropanecarboxylicacid
CC1(C(C1C(=O)O)C(=O)NC2=CC=CC3=NSN=C32)C
InChI=1SC13H13N3O3Sc113(2)8(9(13)12(18)19)11(17)146435710(6)1620157h3589H12H3(H1417)(H1819)
MFCD19710313
ZINC000071283386
ZINC000071283389
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