Vitas-M small molecule compound

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

Catalog ID
STK001485
SMILES O=C(Nc1cccc2c1nsn2)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 C18H19N3O2S MW 341.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O2S/c1-11(2)13-8-7-12(3)9-16(13)23-10-17(22)19-14-5-4-6-15-18(14)21-24-20-15/h4-9,11H,10H2,1-3H3,(H,19,22)
InChIKey
PQQMPQCTOCYKRF-UHFFFAOYSA-N
Synonyms
403670-95-1
403670951
CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC2=CC=CC3=NSN=C32
InChI=1SC18H19N3O2Sc111(2)138712(3)916(13)231017(22)19145461518(14)21242015h4911H10H213H3(H1922)
MFCD02220142
N(213BENZOTHIADIAZOL4YL)2(2ISOPROPYL5METHYLPHENOXY)ACETAMIDE
N(213BENZOTHIADIAZOL4YL)2(5METHYL2(PROPAN2YL)PHENOXY)ACETAMIDE
N(213BENZOTHIADIAZOL4YL)2(5METHYL2PROPAN2YLPHENOXY)ACETAMIDE
N(benzo(c)(125)thiadiazol4yl)2(2isopropyl5methylphenoxy)acetamide
NBENZO(C)125THIADIAZOL4YL2(5METHYL2(METHYLETHYL)PHENOXY)ACETAMIDE
O=C(Nc1cccc2c1nsn2)COc1cc(C)ccc1C(C)C
STK001485
ZINC000000104104
ZINC00104104
ZINC104104

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Available files

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