Vitas-M small molecule compound
N-(3-chlorophenyl)-3-ethyl-6-(4-methoxyphenyl)-6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-7-carboxamide
Catalog ID
STL359835
SMILES CCc1nnc2n1NC(c1ccc(cc1)OC)C(S2)C(=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 C20H20ClN5O2S MW 429.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN5O2S/c1-3-16-23-24-20-26(16)25-17(12-7-9-15(28-2)10-8-12)18(29-20)19(27)22-14-6-4-5-13(21)11-14/h4-11,17-18,25H,3H2,1-2H3,(H,22,27)InChIKey
SZOCQUQPMLFMIZ-UHFFFAOYSA-NSynonyms
891030-06-1891030061
CCC1=NN=C2N1NC(C(S2)C(=O)NC3=CC(=CC=C3)Cl)C4=CC=C(C=C4)OC
InChI=1SC20H20ClN5O2Sc131623242026(16)2517(127915(282)10812)18(2920)19(27)221464513(21)1114h411171825H3H212H3(H2227)
MFCD08107101
N(3chlorophenyl)3ethyl6(4methoxyphenyl)67dihydro5H(124)triazolo(34b)(134)thiadiazine7carboxamide
ZINC000009197186
ZINC000009197205
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