Vitas-M small molecule compound
3-ethyl-N-(4-ethylphenyl)-6-(4-fluorophenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359914
SMILES CCc1ccc(cc1)NC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)F)CC
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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 C21H22FN5OS MW 411.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22FN5OS/c1-3-13-5-11-16(12-6-13)23-20(28)19-18(14-7-9-15(22)10-8-14)26-27-17(4-2)24-25-21(27)29-19/h5-12,18-19,26H,3-4H2,1-2H3,(H,23,28)InChIKey
KOZOTDKNFNAOLL-UHFFFAOYSA-NSynonyms
891036-22-93ethylN(4ethylphenyl)6(4fluorophenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
891036229
CCC1=CC=C(C=C1)NC(=O)C2C(NN3C(=NN=C3S2)CC)C4=CC=C(C=C4)F
InChI=1SC21H22FN5OSc131351116(12613)2320(28)1918(147915(22)10814)262717(42)242521(27)2919h512181926H34H212H3(H2328)
MFCD08107074
ZINC000006812120
ZINC000006812123
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