Vitas-M small molecule compound
3-ethyl-N-(2-fluorophenyl)-6-(4-methylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359785
SMILES CCc1nnc2n1NC(c1ccc(cc1)C)C(S2)C(=O)Nc1ccccc1F
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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 C20H20FN5OS MW 397.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN5OS/c1-3-16-23-24-20-26(16)25-17(13-10-8-12(2)9-11-13)18(28-20)19(27)22-15-7-5-4-6-14(15)21/h4-11,17-18,25H,3H2,1-2H3,(H,22,27)InChIKey
OEPQNAWCUVVNEX-UHFFFAOYSA-NSynonyms
891057-09-33ethylN(2fluorophenyl)6(4methylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
891057093
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC=CC=C3F)C4=CC=C(C=C4)C
InChI=1SC20H20FN5OSc131623242026(16)2517(1310812(2)91113)18(2820)19(27)2215754614(15)21h411171825H3H212H3(H2227)
MFCD08107060
ZINC000006811852
ZINC000006811855
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