Vitas-M small molecule compound
6-(3-chloro-4-methoxyphenyl)-3-phenyl-N-propyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359245
SMILES CCCNC(=O)C1Sc2nnc(n2NC1c1ccc(c(c1)Cl)OC)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 C21H22ClN5O2S MW 443.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN5O2S/c1-3-11-23-20(28)18-17(14-9-10-16(29-2)15(22)12-14)26-27-19(24-25-21(27)30-18)13-7-5-4-6-8-13/h4-10,12,17-18,26H,3,11H2,1-2H3,(H,23,28)InChIKey
VGIBQERBPUDXEA-UHFFFAOYSA-NSynonyms
6(3chloro4methoxyphenyl)3phenylNpropyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
CCCNC(=O)C1C(NN2C(=NN=C2S1)C3=CC=CC=C3)C4=CC(=C(C=C4)OC)Cl
InChI=1SC21H22ClN5O2Sc13112320(28)1817(1491016(292)15(22)1214)262719(242521(27)3018)137546813h41012171826H311H212H3(H2328)
MFCD08098696
ZINC000009238714
ZINC000009238718
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