Vitas-M small molecule compound

4-hydroxy-2-methyl-N-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]quinoline-6-carboxamide

Catalog ID
STK643436
SMILES CCCc1n[nH]/c(=N\C(=O)c2ccc3c(c2)c(O)cc(n3)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 C16H16N4O2S MW 328.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O2S/c1-3-4-14-19-20-16(23-14)18-15(22)10-5-6-12-11(8-10)13(21)7-9(2)17-12/h5-8H,3-4H2,1-2H3,(H,17,21)(H,18,20,22)
InChIKey
JOJWNZRUNNMIMP-UHFFFAOYSA-N
Synonyms
951975-14-7
(4HYDROXY2METHYL(6QUINOLYL))N(5PROPYL(134THIADIAZOL2YL))CARBOXAMIDE
2methyl4oxoN(5propyl134thiadiazol2yl)1Hquinoline6carboxamide
4hydroxy2methylN((2E)5propyl134thiadiazol2(3H)ylidene)quinoline6carboxamide
4HYDROXY2METHYLN(5PROPYL134THIADIAZOL2YL)QUINOLINE6CARBOXAMIDE
4HYDROXY2METHYLQUINOLINE6CARBOXYLICACID(5PROPYL(134)THIADIAZOL2YL)AMIDE
951975147
CCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)NC(=CC3=O)C
CCCc1n(nH)c(=NC(=O)c2ccc3c(c2)c(O)cc(n3)C)s1
InChI=1SC16H16N4O2Sc13414192016(2314)1815(22)10561211(810)13(21)79(2)1712h58H34H212H3(H1721)(H182022)
MFCD18163309
ZINC000013726736
ZINC13726736

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Available files

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