Vitas-M small molecule compound
[6-(3-chloro-4-methoxyphenyl)-3-methyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin-7-yl](morpholin-4-yl)methanone
Catalog ID
STL381360
SMILES COc1ccc(cc1Cl)C1Nn2c(C)nnc2SC1C(=O)N1CCOCC1
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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 C17H20ClN5O3S MW 409.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN5O3S/c1-10-19-20-17-23(10)21-14(11-3-4-13(25-2)12(18)9-11)15(27-17)16(24)22-5-7-26-8-6-22/h3-4,9,14-15,21H,5-8H2,1-2H3InChIKey
LJRLDFKNLKBPEJ-UHFFFAOYSA-NSynonyms
(6(3chloro4methoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)(morpholin4yl)methanone
(6(3chloro4methoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)morpholin4ylmethanone
CC1=NN=C2N1NC(C(S2)C(=O)N3CCOCC3)C4=CC(=C(C=C4)OC)Cl
InChI=1SC17H20ClN5O3Sc11019201723(10)2114(113413(252)12(18)911)15(2717)16(24)2257268622h349141521H58H212H3
MFCD07433477
ZINC000020068891
ZINC000020068899
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