Vitas-M small molecule compound

methyl [2-(propan-2-ylsulfanyl)-1H-benzimidazol-1-yl]acetate

Catalog ID
STL364564
SMILES COC(=O)Cn1c(SC(C)C)nc2c1cccc2

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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 C13H16N2O2S MW 264.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16N2O2S/c1-9(2)18-13-14-10-6-4-5-7-11(10)15(13)8-12(16)17-3/h4-7,9H,8H2,1-3H3
InChIKey
PRTDPQPDLXFSCI-UHFFFAOYSA-N
Synonyms

CC(C)SC1=NC2=CC=CC=C2N1CC(=O)OC
InChI=1SC13H16N2O2Sc19(2)18131410645711(10)15(13)812(16)173h479H8H213H3
methyl(2(propan2ylsulfanyl)1Hbenzimidazol1yl)acetate
METHYL2(2PROPAN2YLSULFANYLBENZIMIDAZOL1YL)ACETATE
MFCD08072292
ZINC000006700556
ZINC06700556
ZINC6700556

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Available files

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