Vitas-M small molecule compound

N-[2-(1,3-benzothiazol-2-yl)-4-chlorophenyl]-2-[5-methyl-2-(propan-2-yl)phenoxy]acetamide

Catalog ID
STK347330
SMILES O=C(Nc1ccc(cc1c1nc2c(s1)cccc2)Cl)COc1cc(C)ccc1C(C)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 C25H23ClN2O2S MW 450.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23ClN2O2S/c1-15(2)18-10-8-16(3)12-22(18)30-14-24(29)27-20-11-9-17(26)13-19(20)25-28-21-6-4-5-7-23(21)31-25/h4-13,15H,14H2,1-3H3,(H,27,29)
InChIKey
BCZWMCNZRXRFAE-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=C(C=C(C=C2)Cl)C3=NC4=CC=CC=C4S3
InChI=1SC25H23ClN2O2Sc115(2)1810816(3)1222(18)301424(29)272011917(26)1319(20)252821645723(21)3125h41315H14H213H3(H2729)
MFCD06758064
N(2(13benzothiazol2yl)4chlorophenyl)2(5methyl2(propan2yl)phenoxy)acetamide
N(2(13benzothiazol2yl)4chlorophenyl)2(5methyl2propan2ylphenoxy)acetamide
ZINC000012860805
ZINC12860805

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Available files

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