Vitas-M small molecule compound
(4-{[(2-cyanoethyl)sulfanyl]methyl}phenoxy)acetic acid
Catalog ID
STL296606
SMILES N#CCCSCc1ccc(cc1)OCC(=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 C12H13NO3S MW 251.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO3S/c13-6-1-7-17-9-10-2-4-11(5-3-10)16-8-12(14)15/h2-5H,1,7-9H2,(H,14,15)InChIKey
MPXGTRJGAYLEEY-UHFFFAOYSA-NSynonyms
(4(((2cyanoethyl)sulfanyl)methyl)phenoxy)aceticacid
2(4(((2cyanoethyl)thio)methyl)phenoxy)aceticacid
2(4(2CYANOETHYLSULFANYLMETHYL)PHENOXY)ACETICACID
C1=CC(=CC=C1CSCCC#N)OCC(=O)O
InChI=1SC12H13NO3Sc13617179102411(5310)16812(14)15h25H179H2(H1415)
MFCD01958071
ZINC000004337442
ZINC4337442
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