Vitas-M small molecule compound
N-(4-ethylphenyl)-6-(4-fluorophenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359143
SMILES CCc1ccc(cc1)NC(=O)C1Sc2nnc(n2NC1c1ccc(cc1)F)c1ccccc1
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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 C25H22FN5OS MW 459.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22FN5OS/c1-2-16-8-14-20(15-9-16)27-24(32)22-21(17-10-12-19(26)13-11-17)30-31-23(28-29-25(31)33-22)18-6-4-3-5-7-18/h3-15,21-22,30H,2H2,1H3,(H,27,32)InChIKey
QHMVLKWYBWEVFG-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)NC(=O)C2C(NN3C(=NN=C3S2)C4=CC=CC=C4)C5=CC=C(C=C5)F
InChI=1SC25H22FN5OSc121681420(15916)2724(32)2221(17101219(26)131117)303123(282925(31)3322)186435718h315212230H2H21H3(H2732)
MFCD08098649
N(4ethylphenyl)6(4fluorophenyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009238370
ZINC000009238374
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