Vitas-M small molecule compound
3,6-diphenyl-N-(2,4,6-trimethylphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359074
SMILES O=C(C1Sc2nnc(n2NC1c1ccccc1)c1ccccc1)Nc1c(C)cc(cc1C)C
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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 C26H25N5OS MW 455.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5OS/c1-16-14-17(2)21(18(3)15-16)27-25(32)23-22(19-10-6-4-7-11-19)30-31-24(28-29-26(31)33-23)20-12-8-5-9-13-20/h4-15,22-23,30H,1-3H3,(H,27,32)InChIKey
DACUNJRZKKPBST-UHFFFAOYSA-NSynonyms
36diphenylN(246trimethylphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CC1=CC(=C(C(=C1)C)NC(=O)C2C(NN3C(=NN=C3S2)C4=CC=CC=C4)C5=CC=CC=C5)C
InChI=1SC26H25N5OSc1161417(2)21(18(3)1516)2725(32)2322(19106471119)303124(282926(31)3323)20128591320h415222330H13H3(H2732)
MFCD08098623
ZINC000009238237
ZINC000009238240
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