Vitas-M small molecule compound

2-hydroxy-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]quinoline-4-carboxamide

Catalog ID
STK658094
SMILES CC(Cc1n[nH]/c(=N\C(=O)c2cc(O)nc3c2cccc3)/s1)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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-9(2)7-14-19-20-16(23-14)18-15(22)11-8-13(21)17-12-6-4-3-5-10(11)12/h3-6,8-9H,7H2,1-2H3,(H,17,21)(H,18,20,22)
InChIKey
NKXAMCVHZZBLMZ-UHFFFAOYSA-N
Synonyms
782453-17-2
782453172
CC(Cc1n(nH)c(=NC(=O)c2cc(O)nc3c2cccc3)s1)C
MFCD18168255
ZINC000013778561

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Available files

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