Vitas-M small molecule compound
N-(3-chlorophenyl)-6-(4-ethoxyphenyl)-3-ethyl-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359859
SMILES CCOc1ccc(cc1)C1Nn2c(CC)nnc2SC1C(=O)Nc1cccc(c1)Cl
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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/c1-3-17-24-25-21-27(17)26-18(13-8-10-16(11-9-13)29-4-2)19(30-21)20(28)23-15-7-5-6-14(22)12-15/h5-12,18-19,26H,3-4H2,1-2H3,(H,23,28)InChIKey
QGNMGFXXZASSRD-UHFFFAOYSA-NSynonyms
891031-92-8891031928
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)OCC
InChI=1SC21H22ClN5O2Sc131724252127(17)2618(1381016(11913)2942)19(3021)20(28)231575614(22)1215h512181926H34H212H3(H2328)
MFCD08107024
N(3chlorophenyl)6(4ethoxyphenyl)3ethyl67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009197520
ZINC000009197537
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