Vitas-M small molecule compound
3-ethyl-6-(4-ethylphenyl)-N-[3-(trifluoromethyl)phenyl]-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359822
SMILES CCc1nnc2n1NC(c1ccc(cc1)CC)C(S2)C(=O)Nc1cccc(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 C22H22F3N5OS MW 461.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22F3N5OS/c1-3-13-8-10-14(11-9-13)18-19(32-21-28-27-17(4-2)30(21)29-18)20(31)26-16-7-5-6-15(12-16)22(23,24)25/h5-12,18-19,29H,3-4H2,1-2H3,(H,26,31)InChIKey
PVBPNOIEYANPTO-UHFFFAOYSA-NSynonyms
891060-21-23ethyl6(4ethylphenyl)N(3(trifluoromethyl)phenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
891060212
CCC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)CC)C(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI=1SC22H22F3N5OSc131381014(11913)1819(3221282717(42)30(21)2918)20(31)261675615(1216)22(2324)25h512181929H34H212H3(H2631)
MFCD08107120
ZINC000009239331
ZINC000009239335
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