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](pyrrolidin-1-yl)methanone
Catalog ID
STL381361
SMILES COc1ccc(cc1Cl)C1Nn2c(C)nnc2SC1C(=O)N1CCCC1
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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 C17H20ClN5O2S MW 393.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN5O2S/c1-10-19-20-17-23(10)21-14(11-5-6-13(25-2)12(18)9-11)15(26-17)16(24)22-7-3-4-8-22/h5-6,9,14-15,21H,3-4,7-8H2,1-2H3InChIKey
YQHLJODUJJFQKF-UHFFFAOYSA-NSynonyms
(6(3chloro4methoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)(pyrrolidin1yl)methanone
(6(3chloro4methoxyphenyl)3methyl67dihydro5H(124)triazolo(34b)(134)thiadiazin7yl)pyrrolidin1ylmethanone
CC1=NN=C2N1NC(C(S2)C(=O)N3CCCC3)C4=CC(=C(C=C4)OC)Cl
InChI=1SC17H20ClN5O2Sc11019201723(10)2114(115613(252)12(18)911)15(2617)16(24)22734822h569141521H3478H212H3
MFCD07433478
ZINC000020068902
ZINC000020068908
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