Vitas-M small molecule compound

propan-2-yl (2-{[2-(3-methylphenoxy)ethyl]sulfanyl}-1H-benzimidazol-1-yl)acetate

Catalog ID
STL450794
SMILES CC(OC(=O)Cn1c(SCCOc2cccc(c2)C)nc2c1cccc2)C

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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 C21H24N2O3S MW 384.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S/c1-15(2)26-20(24)14-23-19-10-5-4-9-18(19)22-21(23)27-12-11-25-17-8-6-7-16(3)13-17/h4-10,13,15H,11-12,14H2,1-3H3
InChIKey
KIDGONYZEPCVDF-UHFFFAOYSA-N
Synonyms

CC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)OC(C)C
InChI=1SC21H24N2O3Sc115(2)2620(24)1423191054918(19)2221(23)271211251786716(3)1317h4101315H111214H213H3
METHYLETHYL2(2(2(3METHYLPHENOXY)ETHYLTHIO)BENZIMIDAZOLYL)ACETATE
MFCD10044622
propan2yl(2((2(3methylphenoxy)ethyl)sulfanyl)1Hbenzimidazol1yl)acetate
propan2yl2(2(2(3methylphenoxy)ethylsulfanyl)benzimidazol1yl)acetate
ZINC000012062361
ZINC12062361

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Available files

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