Vitas-M small molecule compound
[(7E)-7-benzylidene-3-phenyl-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl](4-methyl-1,3-thiazol-5-yl)methanone
Catalog ID
STL176206
SMILES Cc1ncsc1C(=O)N1N=C2C(C1c1ccccc1)CCC/C/2=C\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 C25H23N3OS MW 413.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3OS/c1-17-24(30-16-26-17)25(29)28-23(19-11-6-3-7-12-19)21-14-8-13-20(22(21)27-28)15-18-9-4-2-5-10-18/h2-7,9-12,15-16,21,23H,8,13-14H2,1H3/b20-15+InChIKey
CVEWHOBPQRANRF-HMMYKYKNSA-NSynonyms
1164513-08-9((7E)7benzylidene3phenyl33a4567hexahydro2Hindazol2yl)(4methyl13thiazol5yl)methanone
((7E)7BENZYLIDENE3PHENYL3A456TETRAHYDRO3HINDAZOL2YL)(4METHYL13THIAZOL5YL)METHANONE
1164513089
CC1=C(SC=N1)C(=O)N2C(C3CCCC(=CC4=CC=CC=C4)C3=N2)C5=CC=CC=C5
Cc1ncsc1C(=O)N1N=C2C(C1c1ccccc1)CCCC2=Cc1ccccc1
InChI=1SC25H23N3OSc11724(30162617)25(29)2823(19116371219)211481320(22(21)2728)151894251018h2791215162123H81314H21H3b2015+
MFCD03468053
ZINC000001015905
ZINC000004652202
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