Vitas-M small molecule compound

N-[(2E)-5-(2-methoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-2-(3-methylphenoxy)acetamide

Catalog ID
STL048709
SMILES COc1ccccc1c1n[nH]/c(=N\C(=O)COc2cccc(c2)C)/s1

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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 C18H17N3O3S MW 355.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O3S/c1-12-6-5-7-13(10-12)24-11-16(22)19-18-21-20-17(25-18)14-8-3-4-9-15(14)23-2/h3-10H,11H2,1-2H3,(H,19,21,22)
InChIKey
XUIHHWNHGHLOKH-UHFFFAOYSA-N
Synonyms
850721-02-7
850721027
CC1=CC(=CC=C1)OCC(=O)NC2=NN=C(S2)C3=CC=CC=C3OC
COc1ccccc1c1n(nH)c(=NC(=O)COc2cccc(c2)C)s1
InChI=1SC18H17N3O3Sc11265713(1012)241116(22)1918212017(2518)14834915(14)232h310H11H212H3(H192122)
MFCD07208009
N((2E)5(2methoxyphenyl)134thiadiazol2(3H)ylidene)2(3methylphenoxy)acetamide
N(5(2METHOXYPHENYL)134THIADIAZOL2YL)2(3METHYLPHENOXY)ACETAMIDE
ZINC000009012339
ZINC09012339
ZINC9012339

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Available files

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