Vitas-M small molecule compound

N-{5-[(4-tert-butylphenoxy)methyl]-1,3,4-thiadiazol-2-yl}-2,2-dimethylpropanamide

Catalog ID
STK712231
SMILES O=C(C(C)(C)C)Nc1nnc(s1)COc1ccc(cc1)C(C)(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 C18H25N3O2S MW 347.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O2S/c1-17(2,3)12-7-9-13(10-8-12)23-11-14-20-21-16(24-14)19-15(22)18(4,5)6/h7-10H,11H2,1-6H3,(H,19,21,22)
InChIKey
AQPDFYSIAXHWRK-UHFFFAOYSA-N
Synonyms

CC(C)(C)C1=CC=C(C=C1)OCC2=NN=C(S2)NC(=O)C(C)(C)C
InChI=1SC18H25N3O2Sc117(23)127913(10812)231114202116(2414)1915(22)18(45)6h710H11H216H3(H192122)
MFCD01130437
N(5((4(tertbutyl)phenoxy)methyl)134thiadiazol2yl)pivalamide
N(5((4tertbutylphenoxy)methyl)134thiadiazol2yl)22dimethylpropanamide
ZINC000017045683
ZINC17045683

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Available files

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