Vitas-M small molecule compound

methyl 5-[({5-oxo-1-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}carbonyl)amino]-1,2,3-thiadiazole-4-carboxylate

Catalog ID
STL236168
SMILES COC(=O)c1nnsc1NC(=O)C1CC(=O)N(C1)c1cccc(c1)C(F)(F)F

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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 C16H13F3N4O4S MW 414.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13F3N4O4S/c1-27-15(26)12-14(28-22-21-12)20-13(25)8-5-11(24)23(7-8)10-4-2-3-9(6-10)16(17,18)19/h2-4,6,8H,5,7H2,1H3,(H,20,25)
InChIKey
INQHSJSBYCZABX-UHFFFAOYSA-N
Synonyms
1081141-98-1
1081141981
COC(=O)C1=C(SN=N1)NC(=O)C2CC(=O)N(C2)C3=CC=CC(=C3)C(F)(F)F
InChI=1SC16H13F3N4O4Sc12715(26)1214(28222112)2013(25)8511(24)23(78)104239(610)16(1718)19h2468H57H21H3(H2025)
methyl5(((5oxo1(3(trifluoromethyl)phenyl)pyrrolidin3yl)carbonyl)amino)123thiadiazole4carboxylate
methyl5((5oxo1(3(trifluoromethyl)phenyl)pyrrolidine3carbonyl)amino)thiadiazole4carboxylate
methyl5(5oxo1(3(trifluoromethyl)phenyl)pyrrolidine3carboxamido)123thiadiazole4carboxylate
MFCD12208453
ZINC000020733527
ZINC000020733531

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Available files

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