Vitas-M small molecule compound
N-benzyl-6-(4-methoxyphenyl)-3-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359189
SMILES COc1ccc(cc1)C1Nn2c(SC1C(=O)NCc1ccccc1)nnc2c1ccccc1
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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 C25H23N5O2S MW 457.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O2S/c1-32-20-14-12-18(13-15-20)21-22(24(31)26-16-17-8-4-2-5-9-17)33-25-28-27-23(30(25)29-21)19-10-6-3-7-11-19/h2-15,21-22,29H,16H2,1H3,(H,26,31)InChIKey
PMDVKGRKFSXGRM-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2C(SC3=NN=C(N3N2)C4=CC=CC=C4)C(=O)NCC5=CC=CC=C5
InChI=1SC25H23N5O2Sc13220141218(131520)2122(24(31)2616178425917)3325282723(30(25)2921)19106371119h215212229H16H21H3(H2631)
MFCD08098721
Nbenzyl6(4methoxyphenyl)3phenyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009238873
ZINC000009238876
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