Vitas-M small molecule compound

(5-amino-2,2-dimethyl-1,3,4-thiadiazol-3(2H)-yl)(4-methylphenyl)methanone

Catalog ID
STK434730
SMILES O=C(N1N=C(SC1(C)C)N)c1ccc(cc1)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 C12H15N3OS MW 249.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3OS/c1-8-4-6-9(7-5-8)10(16)15-12(2,3)17-11(13)14-15/h4-7H,1-3H3,(H2,13,14)
InChIKey
NBKJVWIGGFTQGY-UHFFFAOYSA-N
Synonyms

(5amino22dimethyl134thiadiazol3(2H)yl)(4methylphenyl)methanone
(5AMINO22DIMETHYL134THIADIAZOL3YL)(4METHYLPHENYL)METHANONE
5AMINO22DIMETHYL(134THIADIAZOLIN3YL)4METHYLPHENYLKETONE
CC1=CC=C(C=C1)C(=O)N2C(SC(=N2)N)(C)C
InChI=1SC12H15N3OSc18469(758)10(16)1512(23)1711(13)1415h47H13H3(H21314)
MFCD03943739
ZINC000006844997
ZINC06844997
ZINC6844997

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Available files

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