Vitas-M small molecule compound
4-{[(6-bromo-3H-imidazo[4,5-b]pyridin-1-ium-2-yl)sulfanyl]methyl}benzoate
Catalog ID
STL053451
SMILES Brc1cnc2c(c1)[nH+]c([nH]2)SCc1ccc(cc1)C(=O)[O-]
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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 C14H10BrN3O2S MW 364.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H10BrN3O2S/c15-10-5-11-12(16-6-10)18-14(17-11)21-7-8-1-3-9(4-2-8)13(19)20/h1-6H,7H2,(H,19,20)(H,16,17,18)InChIKey
LAPIJMRFIZEVEC-UHFFFAOYSA-NSynonyms
848932-27-44(((6BROMO1HIMIDAZO(45B)PYRIDIN4IUM2YL)SULFANYL)METHYL)BENZOATE
4(((6bromo3Himidazo(45b)pyridin1ium2yl)sulfanyl)methyl)benzoate
4((6BROMO1HIMIDAZO(45B)PYRIDIN2YL)SULFANYLMETHYL)BENZOICACID
4((6BROMO1HIMIDAZO(45B)PYRIDIN4IUM2YL)SULFANYLMETHYL)BENZOATE
848932274
Brc1cnc2c(c1)(nH+)c((nH)2)SCc1ccc(cc1)C(=O)(O)
C1=CC(=CC=C1CSC2=NC3=(NH+)C=C(C=C3N2)Br)C(=O)(O)
InChI=1SC14H10BrN3O2Sc151051112(16610)1814(1711)2178139(428)13(19)20h16H7H2(H1920)(H161718)
MFCD05678368
ZINC000005626252
ZINC5626252
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